USER MOD reduce.3.24.130724 H: found=0, std=0, add=1017, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1017 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 100 SER OG : rot 4:sc= 0.0653 USER MOD Set 1.2: A 102 THR OG1 : rot -45:sc= 0.911 USER MOD Set 1.3: A 111 ASN : amide:sc= 0.85 K(o=1.8,f=0.38) USER MOD Set 1.4: A 113 MET CE :methyl 161:sc= 0 (180deg=0) USER MOD Set 2.1: A 112 THR OG1 : rot 180:sc=7.48e-05 USER MOD Set 2.2: A 121 LYS NZ :NH3+ 170:sc= 0.00168 (180deg=0) USER MOD Set 3.1: A 81 THR OG1 : rot -99:sc= 1.08 USER MOD Set 3.2: A 93 THR OG1 : rot 140:sc= 0.922 USER MOD Set 4.1: A 19 MET CE :methyl -142:sc= 0 (180deg=-0.0622) USER MOD Set 4.2: A 74 MET CE :methyl -148:sc= 0 (180deg=0) USER MOD Set 5.1: A 47 HIS : no HD1:sc= 0 X(o=0,f=0.1) USER MOD Set 5.2: A 64 THR OG1 : rot 180:sc= 0 USER MOD Set 6.1: A 30 GLN : amide:sc= 0.0159 X(o=0.12,f=-0.046) USER MOD Set 6.2: A 33 LYS NZ :NH3+ 145:sc= 0.107 (180deg=0) USER MOD Single : A 2 SER OG : rot -167:sc= 0.208 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot 170:sc= -0.045 USER MOD Single : A 8 GLN : amide:sc= -0.108 X(o=-0.11,f=-0.2) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 0.246 X(o=0.25,f=0) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.00539) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=-0.091) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 61 ASN :FLIP amide:sc= 0 F(o=-0.76,f=0) USER MOD Single : A 69 CYS SG : rot 56:sc= 0.559 USER MOD Single : A 73 THR OG1 : rot 77:sc= 0.0593 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.048) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -0.0776 X(o=-0.078,f=-0.2) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.635) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= -0.343 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ -177:sc= 0.00327 (180deg=0.00234) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 11.894 -11.688 -2.044 1.00 0.00 N ATOM 2 CA SER A 2 11.476 -10.633 -2.976 1.00 0.00 C ATOM 3 C SER A 2 10.581 -9.604 -2.233 1.00 0.00 C ATOM 4 O SER A 2 11.089 -8.569 -1.792 1.00 0.00 O ATOM 5 CB SER A 2 10.893 -11.264 -4.266 1.00 0.00 C ATOM 6 OG SER A 2 10.551 -10.260 -5.215 1.00 0.00 O ATOM 0 HA SER A 2 12.323 -10.046 -3.332 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.621 -11.948 -4.702 1.00 0.00 H new ATOM 0 HB3 SER A 2 10.009 -11.853 -4.020 1.00 0.00 H new ATOM 0 HG SER A 2 10.008 -10.656 -5.928 1.00 0.00 H new ATOM 12 N PHE A 3 9.270 -9.882 -2.093 1.00 0.00 N ATOM 13 CA PHE A 3 8.274 -8.912 -1.554 1.00 0.00 C ATOM 14 C PHE A 3 8.241 -8.662 -0.013 1.00 0.00 C ATOM 15 O PHE A 3 7.534 -7.739 0.400 1.00 0.00 O ATOM 16 CB PHE A 3 6.870 -9.321 -2.086 1.00 0.00 C ATOM 17 CG PHE A 3 6.571 -8.946 -3.550 1.00 0.00 C ATOM 18 CD1 PHE A 3 6.136 -7.653 -3.867 1.00 0.00 C ATOM 19 CD2 PHE A 3 6.701 -9.894 -4.572 1.00 0.00 C ATOM 20 CE1 PHE A 3 5.840 -7.315 -5.186 1.00 0.00 C ATOM 21 CE2 PHE A 3 6.401 -9.551 -5.887 1.00 0.00 C ATOM 22 CZ PHE A 3 5.974 -8.263 -6.193 1.00 0.00 C ATOM 0 H PHE A 3 8.864 -10.782 -2.348 1.00 0.00 H new ATOM 0 HA PHE A 3 8.604 -7.940 -1.920 1.00 0.00 H new ATOM 0 HB2 PHE A 3 6.762 -10.400 -1.978 1.00 0.00 H new ATOM 0 HB3 PHE A 3 6.113 -8.860 -1.451 1.00 0.00 H new ATOM 0 HD1 PHE A 3 6.030 -6.915 -3.086 1.00 0.00 H new ATOM 0 HD2 PHE A 3 7.035 -10.894 -4.339 1.00 0.00 H new ATOM 0 HE1 PHE A 3 5.506 -6.316 -5.426 1.00 0.00 H new ATOM 0 HE2 PHE A 3 6.500 -10.286 -6.672 1.00 0.00 H new ATOM 0 HZ PHE A 3 5.746 -7.999 -7.215 1.00 0.00 H new ATOM 32 N SER A 4 9.007 -9.390 0.831 1.00 0.00 N ATOM 33 CA SER A 4 9.129 -9.080 2.282 1.00 0.00 C ATOM 34 C SER A 4 9.948 -7.774 2.501 1.00 0.00 C ATOM 35 O SER A 4 11.148 -7.731 2.204 1.00 0.00 O ATOM 36 CB SER A 4 9.787 -10.260 3.033 1.00 0.00 C ATOM 37 OG SER A 4 8.973 -11.425 2.995 1.00 0.00 O ATOM 0 H SER A 4 9.553 -10.199 0.535 1.00 0.00 H new ATOM 0 HA SER A 4 8.127 -8.927 2.683 1.00 0.00 H new ATOM 0 HB2 SER A 4 10.758 -10.479 2.588 1.00 0.00 H new ATOM 0 HB3 SER A 4 9.969 -9.976 4.070 1.00 0.00 H new ATOM 0 HG SER A 4 9.419 -12.152 3.477 1.00 0.00 H new ATOM 43 N GLY A 5 9.281 -6.715 2.988 1.00 0.00 N ATOM 44 CA GLY A 5 9.925 -5.396 3.157 1.00 0.00 C ATOM 45 C GLY A 5 8.951 -4.296 3.624 1.00 0.00 C ATOM 46 O GLY A 5 7.767 -4.280 3.273 1.00 0.00 O ATOM 0 H GLY A 5 8.301 -6.743 3.271 1.00 0.00 H new ATOM 0 HA2 GLY A 5 10.735 -5.485 3.881 1.00 0.00 H new ATOM 0 HA3 GLY A 5 10.375 -5.095 2.211 1.00 0.00 H new ATOM 50 N LYS A 6 9.510 -3.335 4.378 1.00 0.00 N ATOM 51 CA LYS A 6 8.808 -2.077 4.753 1.00 0.00 C ATOM 52 C LYS A 6 9.234 -0.980 3.740 1.00 0.00 C ATOM 53 O LYS A 6 10.429 -0.720 3.574 1.00 0.00 O ATOM 54 CB LYS A 6 9.156 -1.640 6.200 1.00 0.00 C ATOM 55 CG LYS A 6 8.683 -2.601 7.312 1.00 0.00 C ATOM 56 CD LYS A 6 8.829 -2.008 8.725 1.00 0.00 C ATOM 57 CE LYS A 6 8.264 -2.933 9.819 1.00 0.00 C ATOM 58 NZ LYS A 6 8.390 -2.324 11.156 1.00 0.00 N ATOM 0 H LYS A 6 10.458 -3.399 4.748 1.00 0.00 H new ATOM 0 HA LYS A 6 7.730 -2.236 4.721 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.237 -1.526 6.277 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.718 -0.658 6.381 1.00 0.00 H new ATOM 0 HG2 LYS A 6 7.639 -2.861 7.140 1.00 0.00 H new ATOM 0 HG3 LYS A 6 9.256 -3.527 7.252 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.883 -1.815 8.927 1.00 0.00 H new ATOM 0 HD3 LYS A 6 8.316 -1.047 8.766 1.00 0.00 H new ATOM 0 HE2 LYS A 6 7.215 -3.146 9.612 1.00 0.00 H new ATOM 0 HE3 LYS A 6 8.792 -3.886 9.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 8.001 -2.972 11.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 9.393 -2.144 11.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 7.865 -1.426 11.180 1.00 0.00 H new ATOM 72 N TYR A 7 8.262 -0.367 3.046 1.00 0.00 N ATOM 73 CA TYR A 7 8.543 0.491 1.861 1.00 0.00 C ATOM 74 C TYR A 7 8.053 1.929 2.184 1.00 0.00 C ATOM 75 O TYR A 7 6.850 2.202 2.136 1.00 0.00 O ATOM 76 CB TYR A 7 7.889 -0.098 0.574 1.00 0.00 C ATOM 77 CG TYR A 7 8.307 -1.530 0.166 1.00 0.00 C ATOM 78 CD1 TYR A 7 9.541 -1.759 -0.456 1.00 0.00 C ATOM 79 CD2 TYR A 7 7.453 -2.614 0.403 1.00 0.00 C ATOM 80 CE1 TYR A 7 9.921 -3.052 -0.806 1.00 0.00 C ATOM 81 CE2 TYR A 7 7.839 -3.907 0.059 1.00 0.00 C ATOM 82 CZ TYR A 7 9.080 -4.126 -0.532 1.00 0.00 C ATOM 83 OH TYR A 7 9.482 -5.404 -0.813 1.00 0.00 O ATOM 0 H TYR A 7 7.271 -0.443 3.277 1.00 0.00 H new ATOM 0 HA TYR A 7 9.613 0.523 1.655 1.00 0.00 H new ATOM 0 HB2 TYR A 7 6.807 -0.086 0.708 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.115 0.570 -0.257 1.00 0.00 H new ATOM 0 HD1 TYR A 7 10.200 -0.929 -0.665 1.00 0.00 H new ATOM 0 HD2 TYR A 7 6.487 -2.446 0.856 1.00 0.00 H new ATOM 0 HE1 TYR A 7 10.871 -3.222 -1.291 1.00 0.00 H new ATOM 0 HE2 TYR A 7 7.177 -4.738 0.250 1.00 0.00 H new ATOM 0 HH TYR A 7 8.851 -6.040 -0.416 1.00 0.00 H new ATOM 93 N GLN A 8 8.985 2.842 2.522 1.00 0.00 N ATOM 94 CA GLN A 8 8.649 4.232 2.944 1.00 0.00 C ATOM 95 C GLN A 8 8.560 5.157 1.702 1.00 0.00 C ATOM 96 O GLN A 8 9.534 5.305 0.958 1.00 0.00 O ATOM 97 CB GLN A 8 9.701 4.719 3.979 1.00 0.00 C ATOM 98 CG GLN A 8 9.376 6.021 4.756 1.00 0.00 C ATOM 99 CD GLN A 8 9.503 7.353 3.989 1.00 0.00 C ATOM 100 OE1 GLN A 8 10.382 7.548 3.147 1.00 0.00 O ATOM 101 NE2 GLN A 8 8.633 8.307 4.280 1.00 0.00 N ATOM 0 H GLN A 8 9.986 2.647 2.513 1.00 0.00 H new ATOM 0 HA GLN A 8 7.672 4.258 3.427 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.856 3.921 4.705 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.647 4.863 3.458 1.00 0.00 H new ATOM 0 HG2 GLN A 8 8.356 5.944 5.131 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.033 6.068 5.625 1.00 0.00 H new ATOM 0 HE21 GLN A 8 7.908 8.140 4.978 1.00 0.00 H new ATOM 0 HE22 GLN A 8 8.688 9.209 3.807 1.00 0.00 H new ATOM 110 N LEU A 9 7.395 5.808 1.526 1.00 0.00 N ATOM 111 CA LEU A 9 7.086 6.658 0.344 1.00 0.00 C ATOM 112 C LEU A 9 8.034 7.883 0.195 1.00 0.00 C ATOM 113 O LEU A 9 8.047 8.775 1.047 1.00 0.00 O ATOM 114 CB LEU A 9 5.587 7.063 0.449 1.00 0.00 C ATOM 115 CG LEU A 9 4.955 7.848 -0.734 1.00 0.00 C ATOM 116 CD1 LEU A 9 4.975 7.068 -2.059 1.00 0.00 C ATOM 117 CD2 LEU A 9 3.509 8.244 -0.370 1.00 0.00 C ATOM 0 H LEU A 9 6.631 5.763 2.201 1.00 0.00 H new ATOM 0 HA LEU A 9 7.261 6.090 -0.570 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.005 6.153 0.593 1.00 0.00 H new ATOM 0 HB3 LEU A 9 5.467 7.664 1.350 1.00 0.00 H new ATOM 0 HG LEU A 9 5.564 8.738 -0.893 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.519 7.672 -2.844 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.005 6.838 -2.330 1.00 0.00 H new ATOM 0 HD13 LEU A 9 4.415 6.140 -1.944 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.063 8.795 -1.198 1.00 0.00 H new ATOM 0 HD22 LEU A 9 2.924 7.345 -0.175 1.00 0.00 H new ATOM 0 HD23 LEU A 9 3.517 8.872 0.521 1.00 0.00 H new ATOM 129 N GLN A 10 8.816 7.893 -0.897 1.00 0.00 N ATOM 130 CA GLN A 10 9.740 9.009 -1.235 1.00 0.00 C ATOM 131 C GLN A 10 9.070 9.996 -2.236 1.00 0.00 C ATOM 132 O GLN A 10 8.880 11.163 -1.882 1.00 0.00 O ATOM 133 CB GLN A 10 11.121 8.515 -1.753 1.00 0.00 C ATOM 134 CG GLN A 10 11.920 7.571 -0.820 1.00 0.00 C ATOM 135 CD GLN A 10 13.437 7.544 -1.083 1.00 0.00 C ATOM 136 OE1 GLN A 10 14.236 7.931 -0.230 1.00 0.00 O ATOM 137 NE2 GLN A 10 13.877 7.086 -2.247 1.00 0.00 N ATOM 0 H GLN A 10 8.832 7.132 -1.576 1.00 0.00 H new ATOM 0 HA GLN A 10 9.942 9.546 -0.308 1.00 0.00 H new ATOM 0 HB2 GLN A 10 10.964 8.002 -2.702 1.00 0.00 H new ATOM 0 HB3 GLN A 10 11.738 9.389 -1.961 1.00 0.00 H new ATOM 0 HG2 GLN A 10 11.749 7.873 0.213 1.00 0.00 H new ATOM 0 HG3 GLN A 10 11.528 6.559 -0.926 1.00 0.00 H new ATOM 0 HE21 GLN A 10 13.214 6.766 -2.953 1.00 0.00 H new ATOM 0 HE22 GLN A 10 14.879 7.054 -2.437 1.00 0.00 H new ATOM 146 N SER A 11 8.730 9.539 -3.464 1.00 0.00 N ATOM 147 CA SER A 11 8.127 10.394 -4.515 1.00 0.00 C ATOM 148 C SER A 11 6.750 9.805 -4.911 1.00 0.00 C ATOM 149 O SER A 11 6.665 8.779 -5.594 1.00 0.00 O ATOM 150 CB SER A 11 9.063 10.504 -5.740 1.00 0.00 C ATOM 151 OG SER A 11 10.277 11.166 -5.403 1.00 0.00 O ATOM 0 H SER A 11 8.865 8.570 -3.754 1.00 0.00 H new ATOM 0 HA SER A 11 7.986 11.403 -4.128 1.00 0.00 H new ATOM 0 HB2 SER A 11 9.283 9.508 -6.123 1.00 0.00 H new ATOM 0 HB3 SER A 11 8.559 11.048 -6.539 1.00 0.00 H new ATOM 0 HG SER A 11 10.851 11.220 -6.196 1.00 0.00 H new ATOM 157 N GLN A 12 5.677 10.506 -4.506 1.00 0.00 N ATOM 158 CA GLN A 12 4.315 10.288 -5.054 1.00 0.00 C ATOM 159 C GLN A 12 4.115 11.196 -6.298 1.00 0.00 C ATOM 160 O GLN A 12 4.274 12.421 -6.259 1.00 0.00 O ATOM 161 CB GLN A 12 3.199 10.495 -3.998 1.00 0.00 C ATOM 162 CG GLN A 12 3.136 11.863 -3.270 1.00 0.00 C ATOM 163 CD GLN A 12 2.991 11.758 -1.742 1.00 0.00 C ATOM 164 OE1 GLN A 12 3.978 11.757 -1.006 1.00 0.00 O ATOM 165 NE2 GLN A 12 1.775 11.646 -1.233 1.00 0.00 N ATOM 0 H GLN A 12 5.722 11.236 -3.795 1.00 0.00 H new ATOM 0 HA GLN A 12 4.232 9.244 -5.355 1.00 0.00 H new ATOM 0 HB2 GLN A 12 2.239 10.332 -4.489 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.306 9.718 -3.241 1.00 0.00 H new ATOM 0 HG2 GLN A 12 4.040 12.426 -3.500 1.00 0.00 H new ATOM 0 HG3 GLN A 12 2.296 12.434 -3.665 1.00 0.00 H new ATOM 0 HE21 GLN A 12 0.962 11.648 -1.849 1.00 0.00 H new ATOM 0 HE22 GLN A 12 1.650 11.558 -0.224 1.00 0.00 H new ATOM 174 N GLU A 13 3.775 10.523 -7.394 1.00 0.00 N ATOM 175 CA GLU A 13 3.552 11.134 -8.726 1.00 0.00 C ATOM 176 C GLU A 13 2.056 10.908 -9.047 1.00 0.00 C ATOM 177 O GLU A 13 1.609 9.763 -9.147 1.00 0.00 O ATOM 178 CB GLU A 13 4.513 10.444 -9.730 1.00 0.00 C ATOM 179 CG GLU A 13 4.448 10.953 -11.186 1.00 0.00 C ATOM 180 CD GLU A 13 5.409 10.190 -12.104 1.00 0.00 C ATOM 181 OE1 GLU A 13 6.625 10.489 -12.089 1.00 0.00 O ATOM 182 OE2 GLU A 13 4.957 9.285 -12.839 1.00 0.00 O ATOM 0 H GLU A 13 3.641 9.512 -7.393 1.00 0.00 H new ATOM 0 HA GLU A 13 3.762 12.202 -8.773 1.00 0.00 H new ATOM 0 HB2 GLU A 13 5.534 10.566 -9.368 1.00 0.00 H new ATOM 0 HB3 GLU A 13 4.301 9.375 -9.730 1.00 0.00 H new ATOM 0 HG2 GLU A 13 3.430 10.850 -11.561 1.00 0.00 H new ATOM 0 HG3 GLU A 13 4.690 12.015 -11.210 1.00 0.00 H new ATOM 189 N ASN A 14 1.289 12.005 -9.189 1.00 0.00 N ATOM 190 CA ASN A 14 -0.194 11.967 -9.392 1.00 0.00 C ATOM 191 C ASN A 14 -1.022 11.513 -8.138 1.00 0.00 C ATOM 192 O ASN A 14 -2.004 10.774 -8.267 1.00 0.00 O ATOM 193 CB ASN A 14 -0.617 11.259 -10.724 1.00 0.00 C ATOM 194 CG ASN A 14 -0.198 11.918 -12.058 1.00 0.00 C ATOM 195 OD1 ASN A 14 0.696 12.760 -12.135 1.00 0.00 O ATOM 196 ND2 ASN A 14 -0.831 11.518 -13.150 1.00 0.00 N ATOM 0 H ASN A 14 1.670 12.951 -9.168 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.476 13.013 -9.515 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -0.211 10.248 -10.709 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -1.703 11.167 -10.723 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -0.578 11.908 -14.058 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -1.572 10.820 -13.083 1.00 0.00 H new ATOM 203 N PHE A 15 -0.682 12.022 -6.930 1.00 0.00 N ATOM 204 CA PHE A 15 -1.526 11.882 -5.710 1.00 0.00 C ATOM 205 C PHE A 15 -2.860 12.687 -5.794 1.00 0.00 C ATOM 206 O PHE A 15 -3.928 12.081 -5.710 1.00 0.00 O ATOM 207 CB PHE A 15 -0.650 12.235 -4.471 1.00 0.00 C ATOM 208 CG PHE A 15 -1.334 12.075 -3.102 1.00 0.00 C ATOM 209 CD1 PHE A 15 -1.332 10.839 -2.451 1.00 0.00 C ATOM 210 CD2 PHE A 15 -1.972 13.167 -2.500 1.00 0.00 C ATOM 211 CE1 PHE A 15 -1.948 10.696 -1.211 1.00 0.00 C ATOM 212 CE2 PHE A 15 -2.600 13.016 -1.267 1.00 0.00 C ATOM 213 CZ PHE A 15 -2.586 11.785 -0.621 1.00 0.00 C ATOM 0 H PHE A 15 0.182 12.540 -6.770 1.00 0.00 H new ATOM 0 HA PHE A 15 -1.864 10.850 -5.615 1.00 0.00 H new ATOM 0 HB2 PHE A 15 0.240 11.606 -4.487 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -0.313 13.267 -4.570 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -0.850 9.990 -2.912 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -1.977 14.128 -2.993 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -1.931 9.741 -0.706 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -3.100 13.858 -0.811 1.00 0.00 H new ATOM 0 HZ PHE A 15 -3.070 11.673 0.338 1.00 0.00 H new ATOM 223 N GLU A 16 -2.796 14.022 -5.948 1.00 0.00 N ATOM 224 CA GLU A 16 -3.996 14.904 -6.036 1.00 0.00 C ATOM 225 C GLU A 16 -4.971 14.672 -7.235 1.00 0.00 C ATOM 226 O GLU A 16 -6.183 14.809 -7.043 1.00 0.00 O ATOM 227 CB GLU A 16 -3.584 16.392 -5.858 1.00 0.00 C ATOM 228 CG GLU A 16 -2.496 16.941 -6.806 1.00 0.00 C ATOM 229 CD GLU A 16 -2.212 18.430 -6.593 1.00 0.00 C ATOM 230 OE1 GLU A 16 -1.524 18.778 -5.606 1.00 0.00 O ATOM 231 OE2 GLU A 16 -2.671 19.257 -7.410 1.00 0.00 O ATOM 0 H GLU A 16 -1.914 14.530 -6.016 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.624 14.597 -5.199 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -4.477 17.006 -5.977 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -3.238 16.527 -4.833 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -1.575 16.377 -6.659 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -2.807 16.780 -7.838 1.00 0.00 H new ATOM 238 N ALA A 17 -4.474 14.279 -8.426 1.00 0.00 N ATOM 239 CA ALA A 17 -5.329 13.753 -9.528 1.00 0.00 C ATOM 240 C ALA A 17 -6.076 12.418 -9.212 1.00 0.00 C ATOM 241 O ALA A 17 -7.277 12.331 -9.476 1.00 0.00 O ATOM 242 CB ALA A 17 -4.472 13.621 -10.801 1.00 0.00 C ATOM 0 H ALA A 17 -3.481 14.314 -8.657 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.132 14.477 -9.670 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -5.087 13.237 -11.615 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.076 14.598 -11.076 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -3.646 12.934 -10.614 1.00 0.00 H new ATOM 248 N PHE A 18 -5.388 11.406 -8.638 1.00 0.00 N ATOM 249 CA PHE A 18 -6.002 10.106 -8.241 1.00 0.00 C ATOM 250 C PHE A 18 -7.025 10.215 -7.067 1.00 0.00 C ATOM 251 O PHE A 18 -8.139 9.709 -7.209 1.00 0.00 O ATOM 252 CB PHE A 18 -4.850 9.096 -7.965 1.00 0.00 C ATOM 253 CG PHE A 18 -5.265 7.645 -7.649 1.00 0.00 C ATOM 254 CD1 PHE A 18 -5.556 7.280 -6.328 1.00 0.00 C ATOM 255 CD2 PHE A 18 -5.325 6.674 -8.655 1.00 0.00 C ATOM 256 CE1 PHE A 18 -5.914 5.972 -6.020 1.00 0.00 C ATOM 257 CE2 PHE A 18 -5.677 5.362 -8.342 1.00 0.00 C ATOM 258 CZ PHE A 18 -5.975 5.015 -7.026 1.00 0.00 C ATOM 0 H PHE A 18 -4.390 11.461 -8.434 1.00 0.00 H new ATOM 0 HA PHE A 18 -6.618 9.743 -9.064 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.194 9.081 -8.836 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -4.261 9.472 -7.129 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.502 8.020 -5.543 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -5.098 6.942 -9.676 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -6.144 5.700 -5.000 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -5.719 4.614 -9.120 1.00 0.00 H new ATOM 0 HZ PHE A 18 -6.254 3.999 -6.787 1.00 0.00 H new ATOM 268 N MET A 19 -6.643 10.846 -5.935 1.00 0.00 N ATOM 269 CA MET A 19 -7.514 11.027 -4.740 1.00 0.00 C ATOM 270 C MET A 19 -8.857 11.771 -5.016 1.00 0.00 C ATOM 271 O MET A 19 -9.908 11.246 -4.644 1.00 0.00 O ATOM 272 CB MET A 19 -6.706 11.722 -3.610 1.00 0.00 C ATOM 273 CG MET A 19 -5.796 10.816 -2.766 1.00 0.00 C ATOM 274 SD MET A 19 -4.612 9.901 -3.774 1.00 0.00 S ATOM 275 CE MET A 19 -4.426 8.414 -2.772 1.00 0.00 C ATOM 0 H MET A 19 -5.714 11.250 -5.818 1.00 0.00 H new ATOM 0 HA MET A 19 -7.817 10.028 -4.427 1.00 0.00 H new ATOM 0 HB2 MET A 19 -6.091 12.501 -4.059 1.00 0.00 H new ATOM 0 HB3 MET A 19 -7.410 12.218 -2.941 1.00 0.00 H new ATOM 0 HG2 MET A 19 -5.257 11.423 -2.039 1.00 0.00 H new ATOM 0 HG3 MET A 19 -6.409 10.113 -2.203 1.00 0.00 H new ATOM 0 HE1 MET A 19 -3.386 8.087 -2.795 1.00 0.00 H new ATOM 0 HE2 MET A 19 -4.716 8.630 -1.744 1.00 0.00 H new ATOM 0 HE3 MET A 19 -5.063 7.625 -3.171 1.00 0.00 H new ATOM 285 N LYS A 20 -8.833 12.938 -5.693 1.00 0.00 N ATOM 286 CA LYS A 20 -10.061 13.629 -6.182 1.00 0.00 C ATOM 287 C LYS A 20 -10.938 12.790 -7.169 1.00 0.00 C ATOM 288 O LYS A 20 -12.164 12.790 -7.021 1.00 0.00 O ATOM 289 CB LYS A 20 -9.633 15.008 -6.763 1.00 0.00 C ATOM 290 CG LYS A 20 -10.743 16.075 -6.903 1.00 0.00 C ATOM 291 CD LYS A 20 -11.534 16.042 -8.231 1.00 0.00 C ATOM 292 CE LYS A 20 -12.605 17.142 -8.370 1.00 0.00 C ATOM 293 NZ LYS A 20 -13.783 16.917 -7.508 1.00 0.00 N ATOM 0 H LYS A 20 -7.970 13.432 -5.919 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.734 13.771 -5.336 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -8.847 15.416 -6.128 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -9.194 14.842 -7.747 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -11.446 15.953 -6.079 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -10.291 17.061 -6.794 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -10.831 16.132 -9.059 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -12.017 15.069 -8.326 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -12.161 18.106 -8.123 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -12.928 17.197 -9.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -14.467 17.689 -7.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -14.228 16.011 -7.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -13.485 16.893 -6.512 1.00 0.00 H new ATOM 307 N ALA A 21 -10.328 12.068 -8.136 1.00 0.00 N ATOM 308 CA ALA A 21 -11.055 11.139 -9.045 1.00 0.00 C ATOM 309 C ALA A 21 -11.757 9.906 -8.396 1.00 0.00 C ATOM 310 O ALA A 21 -12.805 9.498 -8.905 1.00 0.00 O ATOM 311 CB ALA A 21 -10.073 10.682 -10.139 1.00 0.00 C ATOM 0 H ALA A 21 -9.324 12.109 -8.312 1.00 0.00 H new ATOM 0 HA ALA A 21 -11.894 11.714 -9.437 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -10.580 9.999 -10.821 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -9.717 11.550 -10.694 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.226 10.173 -9.678 1.00 0.00 H new ATOM 317 N ILE A 22 -11.221 9.331 -7.294 1.00 0.00 N ATOM 318 CA ILE A 22 -11.916 8.261 -6.513 1.00 0.00 C ATOM 319 C ILE A 22 -13.023 8.857 -5.576 1.00 0.00 C ATOM 320 O ILE A 22 -14.177 8.434 -5.675 1.00 0.00 O ATOM 321 CB ILE A 22 -10.939 7.232 -5.834 1.00 0.00 C ATOM 322 CG1 ILE A 22 -9.957 7.820 -4.776 1.00 0.00 C ATOM 323 CG2 ILE A 22 -10.158 6.416 -6.897 1.00 0.00 C ATOM 324 CD1 ILE A 22 -9.252 6.799 -3.867 1.00 0.00 C ATOM 0 H ILE A 22 -10.307 9.586 -6.919 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.452 7.638 -7.229 1.00 0.00 H new ATOM 0 HB ILE A 22 -11.602 6.578 -5.267 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -9.195 8.398 -5.299 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -10.509 8.517 -4.146 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -9.491 5.713 -6.398 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -10.861 5.867 -7.523 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -9.572 7.094 -7.518 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.595 7.323 -3.173 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -9.998 6.235 -3.306 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -8.663 6.114 -4.477 1.00 0.00 H new ATOM 336 N GLY A 23 -12.687 9.843 -4.720 1.00 0.00 N ATOM 337 CA GLY A 23 -13.678 10.624 -3.949 1.00 0.00 C ATOM 338 C GLY A 23 -13.141 11.063 -2.576 1.00 0.00 C ATOM 339 O GLY A 23 -13.622 10.565 -1.555 1.00 0.00 O ATOM 0 H GLY A 23 -11.722 10.121 -4.543 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -13.967 11.505 -4.522 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.578 10.026 -3.809 1.00 0.00 H new ATOM 343 N LEU A 24 -12.175 12.004 -2.558 1.00 0.00 N ATOM 344 CA LEU A 24 -11.586 12.548 -1.307 1.00 0.00 C ATOM 345 C LEU A 24 -11.764 14.103 -1.183 1.00 0.00 C ATOM 346 O LEU A 24 -11.874 14.787 -2.210 1.00 0.00 O ATOM 347 CB LEU A 24 -10.083 12.146 -1.210 1.00 0.00 C ATOM 348 CG LEU A 24 -9.804 10.829 -0.427 1.00 0.00 C ATOM 349 CD1 LEU A 24 -9.739 9.600 -1.354 1.00 0.00 C ATOM 350 CD2 LEU A 24 -8.534 10.945 0.433 1.00 0.00 C ATOM 0 H LEU A 24 -11.779 12.410 -3.406 1.00 0.00 H new ATOM 0 HA LEU A 24 -12.129 12.110 -0.470 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -9.684 12.043 -2.219 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -9.535 12.958 -0.732 1.00 0.00 H new ATOM 0 HG LEU A 24 -10.650 10.677 0.243 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -9.542 8.707 -0.761 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -10.689 9.487 -1.876 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -8.939 9.735 -2.082 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -8.369 10.009 0.966 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -7.678 11.153 -0.209 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -8.654 11.755 1.152 1.00 0.00 H new ATOM 362 N PRO A 25 -11.752 14.705 0.047 1.00 0.00 N ATOM 363 CA PRO A 25 -11.861 16.176 0.239 1.00 0.00 C ATOM 364 C PRO A 25 -10.541 16.944 -0.059 1.00 0.00 C ATOM 365 O PRO A 25 -9.446 16.391 0.058 1.00 0.00 O ATOM 366 CB PRO A 25 -12.230 16.272 1.735 1.00 0.00 C ATOM 367 CG PRO A 25 -11.607 15.048 2.403 1.00 0.00 C ATOM 368 CD PRO A 25 -11.588 13.971 1.322 1.00 0.00 C ATOM 0 HA PRO A 25 -12.579 16.632 -0.443 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -11.846 17.193 2.173 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -13.312 16.282 1.870 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -10.601 15.264 2.762 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -12.192 14.730 3.266 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -10.652 13.412 1.338 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -12.392 13.250 1.469 1.00 0.00 H new ATOM 376 N GLU A 26 -10.657 18.255 -0.343 1.00 0.00 N ATOM 377 CA GLU A 26 -9.481 19.176 -0.406 1.00 0.00 C ATOM 378 C GLU A 26 -8.591 19.244 0.885 1.00 0.00 C ATOM 379 O GLU A 26 -7.376 19.395 0.754 1.00 0.00 O ATOM 380 CB GLU A 26 -9.971 20.578 -0.861 1.00 0.00 C ATOM 381 CG GLU A 26 -8.852 21.549 -1.302 1.00 0.00 C ATOM 382 CD GLU A 26 -9.390 22.908 -1.757 1.00 0.00 C ATOM 383 OE1 GLU A 26 -9.738 23.054 -2.950 1.00 0.00 O ATOM 384 OE2 GLU A 26 -9.468 23.838 -0.922 1.00 0.00 O ATOM 0 H GLU A 26 -11.549 18.711 -0.534 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.795 18.753 -1.139 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.669 20.452 -1.689 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.527 21.035 -0.043 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -8.159 21.697 -0.474 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.285 21.097 -2.116 1.00 0.00 H new ATOM 391 N GLU A 27 -9.165 19.093 2.102 1.00 0.00 N ATOM 392 CA GLU A 27 -8.387 18.954 3.364 1.00 0.00 C ATOM 393 C GLU A 27 -7.464 17.695 3.394 1.00 0.00 C ATOM 394 O GLU A 27 -6.253 17.874 3.529 1.00 0.00 O ATOM 395 CB GLU A 27 -9.354 19.042 4.577 1.00 0.00 C ATOM 396 CG GLU A 27 -8.649 19.198 5.943 1.00 0.00 C ATOM 397 CD GLU A 27 -9.631 19.256 7.114 1.00 0.00 C ATOM 398 OE1 GLU A 27 -10.010 18.184 7.639 1.00 0.00 O ATOM 399 OE2 GLU A 27 -10.028 20.372 7.517 1.00 0.00 O ATOM 0 H GLU A 27 -10.175 19.064 2.240 1.00 0.00 H new ATOM 0 HA GLU A 27 -7.685 19.786 3.424 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -10.026 19.887 4.430 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -9.971 18.144 4.600 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -7.964 18.363 6.090 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -8.047 20.107 5.934 1.00 0.00 H new ATOM 406 N LEU A 28 -7.988 16.457 3.242 1.00 0.00 N ATOM 407 CA LEU A 28 -7.132 15.225 3.215 1.00 0.00 C ATOM 408 C LEU A 28 -6.193 15.031 1.976 1.00 0.00 C ATOM 409 O LEU A 28 -5.234 14.260 2.069 1.00 0.00 O ATOM 410 CB LEU A 28 -7.991 13.946 3.444 1.00 0.00 C ATOM 411 CG LEU A 28 -8.795 13.830 4.773 1.00 0.00 C ATOM 412 CD1 LEU A 28 -9.699 12.579 4.752 1.00 0.00 C ATOM 413 CD2 LEU A 28 -7.901 13.809 6.030 1.00 0.00 C ATOM 0 H LEU A 28 -8.986 16.274 3.137 1.00 0.00 H new ATOM 0 HA LEU A 28 -6.441 15.389 4.042 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -8.698 13.867 2.618 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -7.328 13.083 3.379 1.00 0.00 H new ATOM 0 HG LEU A 28 -9.407 14.730 4.835 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -10.253 12.515 5.689 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -10.400 12.650 3.920 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -9.084 11.687 4.632 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.526 13.727 6.919 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.225 12.956 5.981 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -7.320 14.730 6.079 1.00 0.00 H new ATOM 425 N ILE A 29 -6.424 15.733 0.850 1.00 0.00 N ATOM 426 CA ILE A 29 -5.485 15.801 -0.307 1.00 0.00 C ATOM 427 C ILE A 29 -4.277 16.742 0.018 1.00 0.00 C ATOM 428 O ILE A 29 -3.128 16.317 -0.114 1.00 0.00 O ATOM 429 CB ILE A 29 -6.261 16.183 -1.621 1.00 0.00 C ATOM 430 CG1 ILE A 29 -7.347 15.127 -1.979 1.00 0.00 C ATOM 431 CG2 ILE A 29 -5.306 16.362 -2.829 1.00 0.00 C ATOM 432 CD1 ILE A 29 -8.354 15.514 -3.072 1.00 0.00 C ATOM 0 H ILE A 29 -7.275 16.278 0.708 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.052 14.817 -0.489 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.748 17.136 -1.415 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.842 14.212 -2.290 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.904 14.891 -1.072 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -5.885 16.625 -3.714 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -4.591 17.156 -2.613 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.770 15.431 -3.010 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -9.056 14.694 -3.227 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.900 16.406 -2.764 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.822 15.717 -4.002 1.00 0.00 H new ATOM 444 N GLN A 30 -4.538 18.002 0.410 1.00 0.00 N ATOM 445 CA GLN A 30 -3.471 18.991 0.744 1.00 0.00 C ATOM 446 C GLN A 30 -2.681 18.733 2.070 1.00 0.00 C ATOM 447 O GLN A 30 -1.514 19.129 2.148 1.00 0.00 O ATOM 448 CB GLN A 30 -4.051 20.434 0.711 1.00 0.00 C ATOM 449 CG GLN A 30 -4.659 20.927 -0.629 1.00 0.00 C ATOM 450 CD GLN A 30 -3.676 21.019 -1.813 1.00 0.00 C ATOM 451 OE1 GLN A 30 -2.908 21.972 -1.933 1.00 0.00 O ATOM 452 NE2 GLN A 30 -3.689 20.046 -2.713 1.00 0.00 N ATOM 0 H GLN A 30 -5.484 18.371 0.507 1.00 0.00 H new ATOM 0 HA GLN A 30 -2.718 18.862 -0.034 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -4.823 20.505 1.478 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -3.256 21.124 0.994 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -5.472 20.257 -0.907 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -5.098 21.911 -0.468 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -4.330 19.260 -2.605 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -3.058 20.084 -3.514 1.00 0.00 H new ATOM 461 N LYS A 31 -3.271 18.064 3.083 1.00 0.00 N ATOM 462 CA LYS A 31 -2.525 17.539 4.260 1.00 0.00 C ATOM 463 C LYS A 31 -1.815 16.185 3.940 1.00 0.00 C ATOM 464 O LYS A 31 -0.616 16.069 4.205 1.00 0.00 O ATOM 465 CB LYS A 31 -3.471 17.435 5.491 1.00 0.00 C ATOM 466 CG LYS A 31 -3.661 18.719 6.335 1.00 0.00 C ATOM 467 CD LYS A 31 -4.521 19.834 5.695 1.00 0.00 C ATOM 468 CE LYS A 31 -4.708 21.090 6.570 1.00 0.00 C ATOM 469 NZ LYS A 31 -5.603 20.871 7.722 1.00 0.00 N ATOM 0 H LYS A 31 -4.272 17.870 3.114 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.731 18.244 4.508 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -4.451 17.111 5.140 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.091 16.651 6.146 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -4.114 18.440 7.286 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -2.677 19.131 6.559 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -4.062 20.131 4.752 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.503 19.425 5.457 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -3.734 21.420 6.933 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -5.109 21.896 5.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -5.836 21.785 8.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -6.477 20.409 7.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -5.128 20.264 8.420 1.00 0.00 H new ATOM 483 N GLY A 32 -2.529 15.191 3.366 1.00 0.00 N ATOM 484 CA GLY A 32 -1.938 13.896 2.954 1.00 0.00 C ATOM 485 C GLY A 32 -0.837 13.854 1.862 1.00 0.00 C ATOM 486 O GLY A 32 -0.129 12.846 1.799 1.00 0.00 O ATOM 0 H GLY A 32 -3.528 15.263 3.175 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -1.524 13.430 3.848 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.756 13.261 2.613 1.00 0.00 H new ATOM 490 N LYS A 33 -0.661 14.903 1.027 1.00 0.00 N ATOM 491 CA LYS A 33 0.505 15.013 0.103 1.00 0.00 C ATOM 492 C LYS A 33 1.888 15.180 0.821 1.00 0.00 C ATOM 493 O LYS A 33 2.849 14.495 0.460 1.00 0.00 O ATOM 494 CB LYS A 33 0.212 16.064 -1.003 1.00 0.00 C ATOM 495 CG LYS A 33 0.271 17.554 -0.598 1.00 0.00 C ATOM 496 CD LYS A 33 -0.166 18.504 -1.731 1.00 0.00 C ATOM 497 CE LYS A 33 0.303 19.966 -1.586 1.00 0.00 C ATOM 498 NZ LYS A 33 -0.269 20.671 -0.423 1.00 0.00 N ATOM 0 H LYS A 33 -1.309 15.689 0.970 1.00 0.00 H new ATOM 0 HA LYS A 33 0.624 14.050 -0.393 1.00 0.00 H new ATOM 0 HB2 LYS A 33 0.922 15.907 -1.815 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -0.781 15.863 -1.405 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -0.368 17.714 0.270 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.288 17.802 -0.295 1.00 0.00 H new ATOM 0 HD2 LYS A 33 0.210 18.112 -2.676 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -1.254 18.494 -1.791 1.00 0.00 H new ATOM 0 HE2 LYS A 33 1.390 19.981 -1.508 1.00 0.00 H new ATOM 0 HE3 LYS A 33 0.041 20.512 -2.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 0.437 21.329 -0.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -1.112 21.203 -0.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -0.535 19.979 0.306 1.00 0.00 H new ATOM 512 N ASP A 34 1.960 16.039 1.861 1.00 0.00 N ATOM 513 CA ASP A 34 3.109 16.106 2.805 1.00 0.00 C ATOM 514 C ASP A 34 3.300 14.845 3.719 1.00 0.00 C ATOM 515 O ASP A 34 4.450 14.498 4.003 1.00 0.00 O ATOM 516 CB ASP A 34 2.953 17.414 3.631 1.00 0.00 C ATOM 517 CG ASP A 34 4.183 17.815 4.458 1.00 0.00 C ATOM 518 OD1 ASP A 34 5.143 18.375 3.884 1.00 0.00 O ATOM 519 OD2 ASP A 34 4.195 17.564 5.684 1.00 0.00 O ATOM 0 H ASP A 34 1.222 16.710 2.075 1.00 0.00 H new ATOM 0 HA ASP A 34 4.027 16.115 2.218 1.00 0.00 H new ATOM 0 HB2 ASP A 34 2.712 18.229 2.949 1.00 0.00 H new ATOM 0 HB3 ASP A 34 2.103 17.300 4.304 1.00 0.00 H new ATOM 524 N ILE A 35 2.214 14.178 4.179 1.00 0.00 N ATOM 525 CA ILE A 35 2.290 12.986 5.075 1.00 0.00 C ATOM 526 C ILE A 35 2.674 11.755 4.190 1.00 0.00 C ATOM 527 O ILE A 35 1.904 11.330 3.322 1.00 0.00 O ATOM 528 CB ILE A 35 0.954 12.783 5.883 1.00 0.00 C ATOM 529 CG1 ILE A 35 0.548 14.016 6.754 1.00 0.00 C ATOM 530 CG2 ILE A 35 1.004 11.522 6.790 1.00 0.00 C ATOM 531 CD1 ILE A 35 -0.936 14.072 7.152 1.00 0.00 C ATOM 0 H ILE A 35 1.259 14.447 3.943 1.00 0.00 H new ATOM 0 HA ILE A 35 3.055 13.124 5.839 1.00 0.00 H new ATOM 0 HB ILE A 35 0.193 12.653 5.114 1.00 0.00 H new ATOM 0 HG12 ILE A 35 1.152 14.015 7.661 1.00 0.00 H new ATOM 0 HG13 ILE A 35 0.796 14.925 6.207 1.00 0.00 H new ATOM 0 HG21 ILE A 35 0.061 11.423 7.328 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.165 10.637 6.174 1.00 0.00 H new ATOM 0 HG23 ILE A 35 1.821 11.620 7.505 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -1.118 14.962 7.754 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.552 14.109 6.254 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -1.191 13.184 7.731 1.00 0.00 H new ATOM 543 N LYS A 36 3.883 11.219 4.427 1.00 0.00 N ATOM 544 CA LYS A 36 4.498 10.169 3.571 1.00 0.00 C ATOM 545 C LYS A 36 4.475 8.829 4.359 1.00 0.00 C ATOM 546 O LYS A 36 5.278 8.620 5.276 1.00 0.00 O ATOM 547 CB LYS A 36 5.936 10.610 3.186 1.00 0.00 C ATOM 548 CG LYS A 36 6.026 11.783 2.174 1.00 0.00 C ATOM 549 CD LYS A 36 7.332 12.604 2.232 1.00 0.00 C ATOM 550 CE LYS A 36 8.597 11.841 1.799 1.00 0.00 C ATOM 551 NZ LYS A 36 9.800 12.688 1.865 1.00 0.00 N ATOM 0 H LYS A 36 4.468 11.496 5.215 1.00 0.00 H new ATOM 0 HA LYS A 36 3.944 10.027 2.643 1.00 0.00 H new ATOM 0 HB2 LYS A 36 6.465 10.896 4.095 1.00 0.00 H new ATOM 0 HB3 LYS A 36 6.461 9.751 2.768 1.00 0.00 H new ATOM 0 HG2 LYS A 36 5.912 11.382 1.167 1.00 0.00 H new ATOM 0 HG3 LYS A 36 5.185 12.455 2.346 1.00 0.00 H new ATOM 0 HD2 LYS A 36 7.220 13.483 1.597 1.00 0.00 H new ATOM 0 HD3 LYS A 36 7.473 12.963 3.251 1.00 0.00 H new ATOM 0 HE2 LYS A 36 8.732 10.969 2.439 1.00 0.00 H new ATOM 0 HE3 LYS A 36 8.468 11.473 0.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 10.630 12.137 1.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 9.683 13.507 1.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 9.938 13.019 2.841 1.00 0.00 H new ATOM 565 N GLY A 37 3.527 7.940 4.007 1.00 0.00 N ATOM 566 CA GLY A 37 3.273 6.696 4.772 1.00 0.00 C ATOM 567 C GLY A 37 4.138 5.480 4.374 1.00 0.00 C ATOM 568 O GLY A 37 4.734 5.431 3.292 1.00 0.00 O ATOM 0 H GLY A 37 2.920 8.057 3.195 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.433 6.902 5.830 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.223 6.427 4.655 1.00 0.00 H new ATOM 572 N VAL A 38 4.165 4.480 5.273 1.00 0.00 N ATOM 573 CA VAL A 38 4.923 3.211 5.062 1.00 0.00 C ATOM 574 C VAL A 38 3.902 2.147 4.558 1.00 0.00 C ATOM 575 O VAL A 38 2.938 1.810 5.255 1.00 0.00 O ATOM 576 CB VAL A 38 5.701 2.734 6.341 1.00 0.00 C ATOM 577 CG1 VAL A 38 6.584 1.489 6.073 1.00 0.00 C ATOM 578 CG2 VAL A 38 6.618 3.812 6.967 1.00 0.00 C ATOM 0 H VAL A 38 3.669 4.517 6.164 1.00 0.00 H new ATOM 0 HA VAL A 38 5.706 3.371 4.321 1.00 0.00 H new ATOM 0 HB VAL A 38 4.899 2.498 7.041 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.098 1.203 6.991 1.00 0.00 H new ATOM 0 HG12 VAL A 38 5.957 0.664 5.737 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.319 1.723 5.303 1.00 0.00 H new ATOM 0 HG21 VAL A 38 7.117 3.400 7.844 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.365 4.123 6.237 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.018 4.673 7.261 1.00 0.00 H new ATOM 588 N SER A 39 4.162 1.611 3.354 1.00 0.00 N ATOM 589 CA SER A 39 3.402 0.471 2.785 1.00 0.00 C ATOM 590 C SER A 39 4.211 -0.831 2.989 1.00 0.00 C ATOM 591 O SER A 39 5.311 -0.983 2.455 1.00 0.00 O ATOM 592 CB SER A 39 3.060 0.720 1.300 1.00 0.00 C ATOM 593 OG SER A 39 4.208 0.984 0.494 1.00 0.00 O ATOM 0 H SER A 39 4.904 1.952 2.743 1.00 0.00 H new ATOM 0 HA SER A 39 2.450 0.368 3.307 1.00 0.00 H new ATOM 0 HB2 SER A 39 2.538 -0.151 0.903 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.373 1.563 1.229 1.00 0.00 H new ATOM 0 HG SER A 39 3.929 1.132 -0.434 1.00 0.00 H new ATOM 599 N GLU A 40 3.650 -1.759 3.774 1.00 0.00 N ATOM 600 CA GLU A 40 4.286 -3.061 4.080 1.00 0.00 C ATOM 601 C GLU A 40 3.691 -4.186 3.192 1.00 0.00 C ATOM 602 O GLU A 40 2.515 -4.164 2.810 1.00 0.00 O ATOM 603 CB GLU A 40 4.070 -3.397 5.576 1.00 0.00 C ATOM 604 CG GLU A 40 4.855 -2.551 6.599 1.00 0.00 C ATOM 605 CD GLU A 40 4.011 -1.532 7.371 1.00 0.00 C ATOM 606 OE1 GLU A 40 3.474 -1.882 8.445 1.00 0.00 O ATOM 607 OE2 GLU A 40 3.874 -0.381 6.905 1.00 0.00 O ATOM 0 H GLU A 40 2.741 -1.635 4.219 1.00 0.00 H new ATOM 0 HA GLU A 40 5.353 -2.991 3.870 1.00 0.00 H new ATOM 0 HB2 GLU A 40 3.007 -3.297 5.797 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.330 -4.444 5.730 1.00 0.00 H new ATOM 0 HG2 GLU A 40 5.333 -3.221 7.313 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.651 -2.021 6.077 1.00 0.00 H new ATOM 614 N ILE A 41 4.536 -5.188 2.901 1.00 0.00 N ATOM 615 CA ILE A 41 4.114 -6.457 2.235 1.00 0.00 C ATOM 616 C ILE A 41 4.954 -7.574 2.930 1.00 0.00 C ATOM 617 O ILE A 41 6.180 -7.469 3.035 1.00 0.00 O ATOM 618 CB ILE A 41 4.290 -6.472 0.670 1.00 0.00 C ATOM 619 CG1 ILE A 41 3.657 -5.248 -0.062 1.00 0.00 C ATOM 620 CG2 ILE A 41 3.730 -7.787 0.056 1.00 0.00 C ATOM 621 CD1 ILE A 41 3.981 -5.116 -1.557 1.00 0.00 C ATOM 0 H ILE A 41 5.533 -5.153 3.116 1.00 0.00 H new ATOM 0 HA ILE A 41 3.040 -6.600 2.353 1.00 0.00 H new ATOM 0 HB ILE A 41 5.366 -6.409 0.511 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.574 -5.302 0.051 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.985 -4.339 0.442 1.00 0.00 H new ATOM 0 HG21 ILE A 41 3.865 -7.770 -1.025 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.264 -8.640 0.475 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.668 -7.874 0.288 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.488 -4.231 -1.959 1.00 0.00 H new ATOM 0 HD12 ILE A 41 5.059 -5.023 -1.689 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.626 -6.001 -2.086 1.00 0.00 H new ATOM 633 N VAL A 42 4.280 -8.650 3.376 1.00 0.00 N ATOM 634 CA VAL A 42 4.926 -9.788 4.093 1.00 0.00 C ATOM 635 C VAL A 42 4.687 -11.045 3.202 1.00 0.00 C ATOM 636 O VAL A 42 3.586 -11.603 3.191 1.00 0.00 O ATOM 637 CB VAL A 42 4.372 -9.932 5.556 1.00 0.00 C ATOM 638 CG1 VAL A 42 4.970 -11.137 6.322 1.00 0.00 C ATOM 639 CG2 VAL A 42 4.580 -8.666 6.425 1.00 0.00 C ATOM 0 H VAL A 42 3.274 -8.764 3.255 1.00 0.00 H new ATOM 0 HA VAL A 42 5.996 -9.634 4.231 1.00 0.00 H new ATOM 0 HB VAL A 42 3.304 -10.091 5.404 1.00 0.00 H new ATOM 0 HG11 VAL A 42 4.545 -11.178 7.325 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.735 -12.059 5.790 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.052 -11.024 6.391 1.00 0.00 H new ATOM 0 HG21 VAL A 42 4.173 -8.838 7.422 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.645 -8.448 6.501 1.00 0.00 H new ATOM 0 HG23 VAL A 42 4.068 -7.821 5.965 1.00 0.00 H new ATOM 649 N GLN A 43 5.735 -11.492 2.482 1.00 0.00 N ATOM 650 CA GLN A 43 5.655 -12.669 1.575 1.00 0.00 C ATOM 651 C GLN A 43 5.743 -14.001 2.375 1.00 0.00 C ATOM 652 O GLN A 43 6.728 -14.261 3.076 1.00 0.00 O ATOM 653 CB GLN A 43 6.776 -12.550 0.504 1.00 0.00 C ATOM 654 CG GLN A 43 6.792 -13.653 -0.582 1.00 0.00 C ATOM 655 CD GLN A 43 7.836 -13.410 -1.688 1.00 0.00 C ATOM 656 OE1 GLN A 43 9.021 -13.209 -1.421 1.00 0.00 O ATOM 657 NE2 GLN A 43 7.436 -13.444 -2.950 1.00 0.00 N ATOM 0 H GLN A 43 6.657 -11.056 2.508 1.00 0.00 H new ATOM 0 HA GLN A 43 4.689 -12.682 1.070 1.00 0.00 H new ATOM 0 HB2 GLN A 43 6.680 -11.583 0.011 1.00 0.00 H new ATOM 0 HB3 GLN A 43 7.740 -12.554 1.013 1.00 0.00 H new ATOM 0 HG2 GLN A 43 6.992 -14.615 -0.109 1.00 0.00 H new ATOM 0 HG3 GLN A 43 5.803 -13.720 -1.035 1.00 0.00 H new ATOM 0 HE21 GLN A 43 6.454 -13.611 -3.169 1.00 0.00 H new ATOM 0 HE22 GLN A 43 8.110 -13.304 -3.703 1.00 0.00 H new ATOM 666 N ASN A 44 4.707 -14.840 2.216 1.00 0.00 N ATOM 667 CA ASN A 44 4.694 -16.240 2.727 1.00 0.00 C ATOM 668 C ASN A 44 4.196 -17.180 1.582 1.00 0.00 C ATOM 669 O ASN A 44 3.097 -17.743 1.652 1.00 0.00 O ATOM 670 CB ASN A 44 3.820 -16.358 4.015 1.00 0.00 C ATOM 671 CG ASN A 44 4.256 -15.530 5.240 1.00 0.00 C ATOM 672 OD1 ASN A 44 3.694 -14.472 5.523 1.00 0.00 O ATOM 673 ND2 ASN A 44 5.251 -15.986 5.986 1.00 0.00 N ATOM 0 H ASN A 44 3.849 -14.577 1.731 1.00 0.00 H new ATOM 0 HA ASN A 44 5.700 -16.543 3.017 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.800 -16.071 3.759 1.00 0.00 H new ATOM 0 HB3 ASN A 44 3.792 -17.407 4.309 1.00 0.00 H new ATOM 0 HD21 ASN A 44 5.558 -15.459 6.804 1.00 0.00 H new ATOM 0 HD22 ASN A 44 5.710 -16.864 5.743 1.00 0.00 H new ATOM 680 N GLY A 45 5.006 -17.337 0.511 1.00 0.00 N ATOM 681 CA GLY A 45 4.633 -18.138 -0.680 1.00 0.00 C ATOM 682 C GLY A 45 3.498 -17.511 -1.523 1.00 0.00 C ATOM 683 O GLY A 45 3.664 -16.426 -2.089 1.00 0.00 O ATOM 0 H GLY A 45 5.932 -16.915 0.446 1.00 0.00 H new ATOM 0 HA2 GLY A 45 5.513 -18.266 -1.310 1.00 0.00 H new ATOM 0 HA3 GLY A 45 4.326 -19.132 -0.356 1.00 0.00 H new ATOM 687 N LYS A 46 2.344 -18.199 -1.555 1.00 0.00 N ATOM 688 CA LYS A 46 1.078 -17.652 -2.126 1.00 0.00 C ATOM 689 C LYS A 46 0.328 -16.641 -1.200 1.00 0.00 C ATOM 690 O LYS A 46 -0.277 -15.706 -1.727 1.00 0.00 O ATOM 691 CB LYS A 46 0.127 -18.810 -2.529 1.00 0.00 C ATOM 692 CG LYS A 46 0.594 -19.649 -3.738 1.00 0.00 C ATOM 693 CD LYS A 46 -0.421 -20.736 -4.144 1.00 0.00 C ATOM 694 CE LYS A 46 0.061 -21.570 -5.344 1.00 0.00 C ATOM 695 NZ LYS A 46 -0.936 -22.584 -5.728 1.00 0.00 N ATOM 0 H LYS A 46 2.251 -19.147 -1.190 1.00 0.00 H new ATOM 0 HA LYS A 46 1.378 -17.080 -3.004 1.00 0.00 H new ATOM 0 HB2 LYS A 46 0.003 -19.473 -1.673 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -0.854 -18.392 -2.753 1.00 0.00 H new ATOM 0 HG2 LYS A 46 0.769 -18.988 -4.587 1.00 0.00 H new ATOM 0 HG3 LYS A 46 1.547 -20.121 -3.500 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -0.601 -21.396 -3.295 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -1.373 -20.266 -4.391 1.00 0.00 H new ATOM 0 HE2 LYS A 46 0.258 -20.912 -6.191 1.00 0.00 H new ATOM 0 HE3 LYS A 46 1.003 -22.059 -5.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -0.582 -23.129 -6.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -1.105 -23.225 -4.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -1.826 -22.114 -5.989 1.00 0.00 H new ATOM 709 N HIS A 47 0.360 -16.805 0.140 1.00 0.00 N ATOM 710 CA HIS A 47 -0.196 -15.813 1.103 1.00 0.00 C ATOM 711 C HIS A 47 0.691 -14.536 1.171 1.00 0.00 C ATOM 712 O HIS A 47 1.921 -14.617 1.234 1.00 0.00 O ATOM 713 CB HIS A 47 -0.306 -16.438 2.521 1.00 0.00 C ATOM 714 CG HIS A 47 -1.387 -17.508 2.690 1.00 0.00 C ATOM 715 ND1 HIS A 47 -1.141 -18.867 2.720 1.00 0.00 N ATOM 716 CD2 HIS A 47 -2.760 -17.265 2.877 1.00 0.00 C ATOM 717 CE1 HIS A 47 -2.413 -19.330 2.933 1.00 0.00 C ATOM 718 NE2 HIS A 47 -3.461 -18.451 3.044 1.00 0.00 N ATOM 0 H HIS A 47 0.769 -17.624 0.590 1.00 0.00 H new ATOM 0 HA HIS A 47 -1.188 -15.531 0.750 1.00 0.00 H new ATOM 0 HB2 HIS A 47 0.658 -16.876 2.781 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -0.496 -15.639 3.237 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.210 -16.283 2.889 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -2.592 -20.392 3.014 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -4.455 -18.619 3.202 1.00 0.00 H new ATOM 726 N PHE A 48 0.042 -13.362 1.153 1.00 0.00 N ATOM 727 CA PHE A 48 0.732 -12.046 1.197 1.00 0.00 C ATOM 728 C PHE A 48 -0.089 -11.124 2.129 1.00 0.00 C ATOM 729 O PHE A 48 -1.154 -10.627 1.742 1.00 0.00 O ATOM 730 CB PHE A 48 0.838 -11.391 -0.204 1.00 0.00 C ATOM 731 CG PHE A 48 1.862 -11.982 -1.182 1.00 0.00 C ATOM 732 CD1 PHE A 48 1.506 -13.024 -2.041 1.00 0.00 C ATOM 733 CD2 PHE A 48 3.143 -11.431 -1.270 1.00 0.00 C ATOM 734 CE1 PHE A 48 2.426 -13.527 -2.960 1.00 0.00 C ATOM 735 CE2 PHE A 48 4.047 -11.916 -2.208 1.00 0.00 C ATOM 736 CZ PHE A 48 3.695 -12.963 -3.049 1.00 0.00 C ATOM 0 H PHE A 48 -0.974 -13.289 1.108 1.00 0.00 H new ATOM 0 HA PHE A 48 1.749 -12.192 1.560 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.144 -11.439 -0.674 1.00 0.00 H new ATOM 0 HB3 PHE A 48 1.074 -10.336 -0.066 1.00 0.00 H new ATOM 0 HD1 PHE A 48 0.512 -13.443 -1.993 1.00 0.00 H new ATOM 0 HD2 PHE A 48 3.431 -10.627 -0.608 1.00 0.00 H new ATOM 0 HE1 PHE A 48 2.154 -14.352 -3.601 1.00 0.00 H new ATOM 0 HE2 PHE A 48 5.030 -11.475 -2.283 1.00 0.00 H new ATOM 0 HZ PHE A 48 4.405 -13.339 -3.771 1.00 0.00 H new ATOM 746 N LYS A 49 0.431 -10.877 3.344 1.00 0.00 N ATOM 747 CA LYS A 49 -0.205 -9.949 4.310 1.00 0.00 C ATOM 748 C LYS A 49 0.386 -8.531 4.114 1.00 0.00 C ATOM 749 O LYS A 49 1.491 -8.223 4.573 1.00 0.00 O ATOM 750 CB LYS A 49 -0.016 -10.472 5.751 1.00 0.00 C ATOM 751 CG LYS A 49 -0.914 -9.794 6.812 1.00 0.00 C ATOM 752 CD LYS A 49 -0.554 -10.159 8.271 1.00 0.00 C ATOM 753 CE LYS A 49 -0.669 -11.646 8.668 1.00 0.00 C ATOM 754 NZ LYS A 49 -2.056 -12.150 8.649 1.00 0.00 N ATOM 0 H LYS A 49 1.291 -11.305 3.686 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.279 -9.893 4.132 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -0.212 -11.544 5.762 1.00 0.00 H new ATOM 0 HB3 LYS A 49 1.027 -10.336 6.038 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.846 -8.713 6.692 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.951 -10.071 6.625 1.00 0.00 H new ATOM 0 HD2 LYS A 49 0.470 -9.836 8.459 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.197 -9.580 8.934 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -0.063 -12.244 7.988 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -0.254 -11.781 9.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -2.065 -13.153 8.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.634 -11.602 9.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.448 -12.051 7.691 1.00 0.00 H new ATOM 768 N PHE A 50 -0.404 -7.673 3.459 1.00 0.00 N ATOM 769 CA PHE A 50 -0.105 -6.220 3.371 1.00 0.00 C ATOM 770 C PHE A 50 -0.545 -5.485 4.666 1.00 0.00 C ATOM 771 O PHE A 50 -1.545 -5.851 5.293 1.00 0.00 O ATOM 772 CB PHE A 50 -0.661 -5.575 2.066 1.00 0.00 C ATOM 773 CG PHE A 50 -2.176 -5.291 1.953 1.00 0.00 C ATOM 774 CD1 PHE A 50 -2.716 -4.107 2.473 1.00 0.00 C ATOM 775 CD2 PHE A 50 -3.014 -6.185 1.284 1.00 0.00 C ATOM 776 CE1 PHE A 50 -4.074 -3.831 2.332 1.00 0.00 C ATOM 777 CE2 PHE A 50 -4.366 -5.894 1.118 1.00 0.00 C ATOM 778 CZ PHE A 50 -4.896 -4.720 1.646 1.00 0.00 C ATOM 0 H PHE A 50 -1.259 -7.950 2.978 1.00 0.00 H new ATOM 0 HA PHE A 50 0.976 -6.104 3.299 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -0.138 -4.630 1.918 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -0.386 -6.225 1.235 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.076 -3.405 2.986 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -2.612 -7.108 0.893 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.489 -2.928 2.755 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -5.003 -6.580 0.579 1.00 0.00 H new ATOM 0 HZ PHE A 50 -5.946 -4.499 1.523 1.00 0.00 H new ATOM 788 N THR A 51 0.195 -4.427 5.026 1.00 0.00 N ATOM 789 CA THR A 51 -0.213 -3.495 6.110 1.00 0.00 C ATOM 790 C THR A 51 0.126 -2.064 5.602 1.00 0.00 C ATOM 791 O THR A 51 1.224 -1.551 5.834 1.00 0.00 O ATOM 792 CB THR A 51 0.442 -3.905 7.466 1.00 0.00 C ATOM 793 OG1 THR A 51 0.051 -5.228 7.827 1.00 0.00 O ATOM 794 CG2 THR A 51 0.059 -2.994 8.638 1.00 0.00 C ATOM 0 H THR A 51 1.084 -4.187 4.586 1.00 0.00 H new ATOM 0 HA THR A 51 -1.280 -3.530 6.329 1.00 0.00 H new ATOM 0 HB THR A 51 1.516 -3.824 7.297 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.470 -5.472 8.678 1.00 0.00 H new ATOM 0 HG21 THR A 51 0.552 -3.342 9.546 1.00 0.00 H new ATOM 0 HG22 THR A 51 0.373 -1.973 8.423 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.021 -3.019 8.780 1.00 0.00 H new ATOM 802 N ILE A 52 -0.832 -1.431 4.898 1.00 0.00 N ATOM 803 CA ILE A 52 -0.645 -0.081 4.291 1.00 0.00 C ATOM 804 C ILE A 52 -1.150 1.004 5.279 1.00 0.00 C ATOM 805 O ILE A 52 -2.330 1.038 5.638 1.00 0.00 O ATOM 806 CB ILE A 52 -1.229 0.019 2.839 1.00 0.00 C ATOM 807 CG1 ILE A 52 -0.803 1.340 2.128 1.00 0.00 C ATOM 808 CG2 ILE A 52 -2.761 -0.201 2.728 1.00 0.00 C ATOM 809 CD1 ILE A 52 -0.895 1.333 0.595 1.00 0.00 C ATOM 0 H ILE A 52 -1.755 -1.831 4.730 1.00 0.00 H new ATOM 0 HA ILE A 52 0.419 0.102 4.139 1.00 0.00 H new ATOM 0 HB ILE A 52 -0.780 -0.825 2.315 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -1.425 2.151 2.507 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.225 1.567 2.411 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -3.067 -0.112 1.686 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -3.013 -1.195 3.096 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -3.280 0.549 3.324 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -0.575 2.300 0.207 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -0.250 0.550 0.195 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -1.925 1.143 0.293 1.00 0.00 H new ATOM 821 N THR A 53 -0.230 1.894 5.685 1.00 0.00 N ATOM 822 CA THR A 53 -0.536 3.010 6.619 1.00 0.00 C ATOM 823 C THR A 53 -0.896 4.253 5.755 1.00 0.00 C ATOM 824 O THR A 53 -0.013 4.972 5.276 1.00 0.00 O ATOM 825 CB THR A 53 0.643 3.237 7.613 1.00 0.00 C ATOM 826 OG1 THR A 53 0.968 2.022 8.286 1.00 0.00 O ATOM 827 CG2 THR A 53 0.333 4.278 8.705 1.00 0.00 C ATOM 0 H THR A 53 0.744 1.868 5.382 1.00 0.00 H new ATOM 0 HA THR A 53 -1.390 2.783 7.257 1.00 0.00 H new ATOM 0 HB THR A 53 1.467 3.600 6.999 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.711 2.180 8.905 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.197 4.385 9.361 1.00 0.00 H new ATOM 0 HG22 THR A 53 0.109 5.238 8.240 1.00 0.00 H new ATOM 0 HG23 THR A 53 -0.527 3.948 9.288 1.00 0.00 H new ATOM 835 N ALA A 54 -2.211 4.474 5.563 1.00 0.00 N ATOM 836 CA ALA A 54 -2.740 5.602 4.759 1.00 0.00 C ATOM 837 C ALA A 54 -3.056 6.798 5.693 1.00 0.00 C ATOM 838 O ALA A 54 -4.134 6.872 6.296 1.00 0.00 O ATOM 839 CB ALA A 54 -3.974 5.110 3.979 1.00 0.00 C ATOM 0 H ALA A 54 -2.939 3.879 5.959 1.00 0.00 H new ATOM 0 HA ALA A 54 -2.005 5.952 4.035 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -4.377 5.928 3.381 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -3.686 4.289 3.323 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -4.734 4.765 4.680 1.00 0.00 H new ATOM 845 N GLY A 55 -2.070 7.707 5.839 1.00 0.00 N ATOM 846 CA GLY A 55 -2.155 8.843 6.784 1.00 0.00 C ATOM 847 C GLY A 55 -1.971 8.406 8.252 1.00 0.00 C ATOM 848 O GLY A 55 -0.877 7.998 8.651 1.00 0.00 O ATOM 0 H GLY A 55 -1.198 7.676 5.310 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -1.394 9.580 6.530 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -3.123 9.332 6.673 1.00 0.00 H new ATOM 852 N SER A 56 -3.072 8.465 9.020 1.00 0.00 N ATOM 853 CA SER A 56 -3.152 7.871 10.384 1.00 0.00 C ATOM 854 C SER A 56 -3.707 6.412 10.395 1.00 0.00 C ATOM 855 O SER A 56 -3.090 5.547 11.026 1.00 0.00 O ATOM 856 CB SER A 56 -3.926 8.811 11.338 1.00 0.00 C ATOM 857 OG SER A 56 -5.289 8.977 10.957 1.00 0.00 O ATOM 0 H SER A 56 -3.934 8.922 8.723 1.00 0.00 H new ATOM 0 HA SER A 56 -2.131 7.780 10.755 1.00 0.00 H new ATOM 0 HB2 SER A 56 -3.882 8.411 12.351 1.00 0.00 H new ATOM 0 HB3 SER A 56 -3.437 9.785 11.358 1.00 0.00 H new ATOM 0 HG SER A 56 -5.735 9.577 11.591 1.00 0.00 H new ATOM 863 N LYS A 57 -4.853 6.137 9.730 1.00 0.00 N ATOM 864 CA LYS A 57 -5.537 4.817 9.787 1.00 0.00 C ATOM 865 C LYS A 57 -4.799 3.742 8.941 1.00 0.00 C ATOM 866 O LYS A 57 -4.468 3.967 7.772 1.00 0.00 O ATOM 867 CB LYS A 57 -7.015 4.943 9.313 1.00 0.00 C ATOM 868 CG LYS A 57 -7.967 5.774 10.206 1.00 0.00 C ATOM 869 CD LYS A 57 -8.291 5.137 11.578 1.00 0.00 C ATOM 870 CE LYS A 57 -9.242 5.964 12.465 1.00 0.00 C ATOM 871 NZ LYS A 57 -10.630 5.996 11.964 1.00 0.00 N ATOM 0 H LYS A 57 -5.331 6.818 9.140 1.00 0.00 H new ATOM 0 HA LYS A 57 -5.520 4.493 10.827 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -7.015 5.383 8.316 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -7.428 3.939 9.219 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -7.522 6.755 10.373 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -8.900 5.935 9.666 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -8.734 4.155 11.412 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -7.358 4.978 12.119 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -9.237 5.551 13.474 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -8.865 6.984 12.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -11.217 6.567 12.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -10.646 6.416 11.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -11.006 5.027 11.921 1.00 0.00 H new ATOM 885 N VAL A 58 -4.563 2.577 9.570 1.00 0.00 N ATOM 886 CA VAL A 58 -3.819 1.441 8.962 1.00 0.00 C ATOM 887 C VAL A 58 -4.820 0.337 8.492 1.00 0.00 C ATOM 888 O VAL A 58 -5.690 -0.110 9.247 1.00 0.00 O ATOM 889 CB VAL A 58 -2.684 0.957 9.927 1.00 0.00 C ATOM 890 CG1 VAL A 58 -3.150 0.405 11.297 1.00 0.00 C ATOM 891 CG2 VAL A 58 -1.739 -0.055 9.250 1.00 0.00 C ATOM 0 H VAL A 58 -4.882 2.388 10.520 1.00 0.00 H new ATOM 0 HA VAL A 58 -3.299 1.756 8.057 1.00 0.00 H new ATOM 0 HB VAL A 58 -2.145 1.878 10.150 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -2.282 0.100 11.881 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.695 1.180 11.835 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -3.802 -0.455 11.140 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -0.968 -0.362 9.957 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -2.309 -0.928 8.932 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -1.271 0.409 8.382 1.00 0.00 H new ATOM 901 N ILE A 59 -4.661 -0.083 7.224 1.00 0.00 N ATOM 902 CA ILE A 59 -5.558 -1.054 6.544 1.00 0.00 C ATOM 903 C ILE A 59 -4.690 -2.324 6.281 1.00 0.00 C ATOM 904 O ILE A 59 -3.728 -2.267 5.509 1.00 0.00 O ATOM 905 CB ILE A 59 -6.176 -0.435 5.234 1.00 0.00 C ATOM 906 CG1 ILE A 59 -7.032 0.857 5.456 1.00 0.00 C ATOM 907 CG2 ILE A 59 -7.052 -1.465 4.486 1.00 0.00 C ATOM 908 CD1 ILE A 59 -6.260 2.179 5.331 1.00 0.00 C ATOM 0 H ILE A 59 -3.899 0.242 6.630 1.00 0.00 H new ATOM 0 HA ILE A 59 -6.422 -1.316 7.155 1.00 0.00 H new ATOM 0 HB ILE A 59 -5.305 -0.152 4.643 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -7.849 0.861 4.734 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -7.483 0.810 6.447 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -7.464 -1.007 3.587 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -6.444 -2.327 4.209 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -7.866 -1.789 5.134 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -6.939 3.014 5.501 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -5.460 2.205 6.071 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -5.832 2.257 4.332 1.00 0.00 H new ATOM 920 N GLN A 60 -5.054 -3.460 6.908 1.00 0.00 N ATOM 921 CA GLN A 60 -4.292 -4.732 6.801 1.00 0.00 C ATOM 922 C GLN A 60 -5.217 -5.915 6.409 1.00 0.00 C ATOM 923 O GLN A 60 -6.267 -6.138 7.023 1.00 0.00 O ATOM 924 CB GLN A 60 -3.457 -5.031 8.076 1.00 0.00 C ATOM 925 CG GLN A 60 -4.157 -5.203 9.447 1.00 0.00 C ATOM 926 CD GLN A 60 -4.580 -3.888 10.129 1.00 0.00 C ATOM 927 OE1 GLN A 60 -3.755 -3.022 10.418 1.00 0.00 O ATOM 928 NE2 GLN A 60 -5.863 -3.715 10.408 1.00 0.00 N ATOM 0 H GLN A 60 -5.880 -3.528 7.502 1.00 0.00 H new ATOM 0 HA GLN A 60 -3.571 -4.607 5.993 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -2.893 -5.944 7.885 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -2.732 -4.224 8.183 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -5.041 -5.826 9.311 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -3.486 -5.743 10.116 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -6.540 -4.438 10.165 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -6.174 -2.858 10.866 1.00 0.00 H new ATOM 937 N ASN A 61 -4.797 -6.665 5.372 1.00 0.00 N ATOM 938 CA ASN A 61 -5.556 -7.836 4.837 1.00 0.00 C ATOM 939 C ASN A 61 -4.563 -8.837 4.175 1.00 0.00 C ATOM 940 O ASN A 61 -3.603 -8.435 3.506 1.00 0.00 O ATOM 941 CB ASN A 61 -6.641 -7.459 3.782 1.00 0.00 C ATOM 942 CG ASN A 61 -7.808 -6.573 4.247 1.00 0.00 C ATOM 943 OD1 ASN A 61 -7.684 -5.266 4.082 1.00 0.00 O flip ATOM 944 ND2 ASN A 61 -8.822 -7.053 4.752 1.00 0.00 N flip ATOM 0 H ASN A 61 -3.925 -6.485 4.875 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.072 -8.275 5.691 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -6.144 -6.953 2.955 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -7.059 -8.384 3.385 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -8.903 -8.063 4.873 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -9.582 -6.441 5.050 1.00 0.00 H new ATOM 951 N GLU A 62 -4.842 -10.150 4.322 1.00 0.00 N ATOM 952 CA GLU A 62 -4.037 -11.227 3.683 1.00 0.00 C ATOM 953 C GLU A 62 -4.783 -11.793 2.442 1.00 0.00 C ATOM 954 O GLU A 62 -5.866 -12.375 2.564 1.00 0.00 O ATOM 955 CB GLU A 62 -3.682 -12.309 4.737 1.00 0.00 C ATOM 956 CG GLU A 62 -2.665 -13.364 4.244 1.00 0.00 C ATOM 957 CD GLU A 62 -2.213 -14.326 5.345 1.00 0.00 C ATOM 958 OE1 GLU A 62 -2.959 -15.279 5.661 1.00 0.00 O ATOM 959 OE2 GLU A 62 -1.105 -14.137 5.895 1.00 0.00 O ATOM 0 H GLU A 62 -5.622 -10.497 4.880 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.094 -10.824 3.313 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.279 -11.819 5.623 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.597 -12.817 5.042 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.111 -13.937 3.431 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -1.793 -12.855 3.835 1.00 0.00 H new ATOM 966 N PHE A 63 -4.155 -11.641 1.260 1.00 0.00 N ATOM 967 CA PHE A 63 -4.625 -12.259 -0.009 1.00 0.00 C ATOM 968 C PHE A 63 -3.799 -13.521 -0.360 1.00 0.00 C ATOM 969 O PHE A 63 -2.570 -13.531 -0.243 1.00 0.00 O ATOM 970 CB PHE A 63 -4.614 -11.255 -1.197 1.00 0.00 C ATOM 971 CG PHE A 63 -3.300 -10.549 -1.587 1.00 0.00 C ATOM 972 CD1 PHE A 63 -2.412 -11.145 -2.490 1.00 0.00 C ATOM 973 CD2 PHE A 63 -3.014 -9.277 -1.082 1.00 0.00 C ATOM 974 CE1 PHE A 63 -1.254 -10.475 -2.879 1.00 0.00 C ATOM 975 CE2 PHE A 63 -1.856 -8.609 -1.475 1.00 0.00 C ATOM 976 CZ PHE A 63 -0.979 -9.207 -2.373 1.00 0.00 C ATOM 0 H PHE A 63 -3.306 -11.087 1.151 1.00 0.00 H new ATOM 0 HA PHE A 63 -5.660 -12.556 0.157 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -4.971 -11.789 -2.078 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -5.347 -10.480 -0.975 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.625 -12.127 -2.886 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -3.694 -8.810 -0.384 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.569 -10.939 -3.573 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -1.640 -7.627 -1.082 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.083 -8.687 -2.679 1.00 0.00 H new ATOM 986 N THR A 64 -4.493 -14.542 -0.883 1.00 0.00 N ATOM 987 CA THR A 64 -3.843 -15.717 -1.523 1.00 0.00 C ATOM 988 C THR A 64 -3.853 -15.473 -3.062 1.00 0.00 C ATOM 989 O THR A 64 -4.895 -15.175 -3.660 1.00 0.00 O ATOM 990 CB THR A 64 -4.574 -17.036 -1.129 1.00 0.00 C ATOM 991 OG1 THR A 64 -4.715 -17.126 0.286 1.00 0.00 O ATOM 992 CG2 THR A 64 -3.843 -18.312 -1.583 1.00 0.00 C ATOM 0 H THR A 64 -5.512 -14.586 -0.880 1.00 0.00 H new ATOM 0 HA THR A 64 -2.815 -15.830 -1.180 1.00 0.00 H new ATOM 0 HB THR A 64 -5.537 -16.984 -1.637 1.00 0.00 H new ATOM 0 HG1 THR A 64 -5.177 -17.959 0.516 1.00 0.00 H new ATOM 0 HG21 THR A 64 -4.413 -19.188 -1.272 1.00 0.00 H new ATOM 0 HG22 THR A 64 -3.746 -18.309 -2.669 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.852 -18.344 -1.130 1.00 0.00 H new ATOM 1000 N VAL A 65 -2.677 -15.633 -3.696 1.00 0.00 N ATOM 1001 CA VAL A 65 -2.497 -15.435 -5.164 1.00 0.00 C ATOM 1002 C VAL A 65 -3.135 -16.633 -5.940 1.00 0.00 C ATOM 1003 O VAL A 65 -2.914 -17.803 -5.609 1.00 0.00 O ATOM 1004 CB VAL A 65 -0.980 -15.170 -5.465 1.00 0.00 C ATOM 1005 CG1 VAL A 65 -0.546 -15.326 -6.937 1.00 0.00 C ATOM 1006 CG2 VAL A 65 -0.547 -13.755 -5.010 1.00 0.00 C ATOM 0 H VAL A 65 -1.819 -15.903 -3.214 1.00 0.00 H new ATOM 0 HA VAL A 65 -3.027 -14.552 -5.522 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.485 -15.955 -4.894 1.00 0.00 H new ATOM 0 HG11 VAL A 65 0.520 -15.119 -7.026 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -0.747 -16.344 -7.270 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -1.104 -14.625 -7.557 1.00 0.00 H new ATOM 0 HG21 VAL A 65 0.509 -13.608 -5.235 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.138 -13.006 -5.538 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.707 -13.653 -3.937 1.00 0.00 H new ATOM 1016 N GLY A 66 -3.946 -16.288 -6.953 1.00 0.00 N ATOM 1017 CA GLY A 66 -4.872 -17.244 -7.610 1.00 0.00 C ATOM 1018 C GLY A 66 -6.368 -17.006 -7.284 1.00 0.00 C ATOM 1019 O GLY A 66 -7.181 -16.884 -8.204 1.00 0.00 O ATOM 0 H GLY A 66 -3.984 -15.346 -7.343 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -4.733 -17.183 -8.689 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.603 -18.257 -7.310 1.00 0.00 H new ATOM 1023 N GLU A 67 -6.724 -16.962 -5.985 1.00 0.00 N ATOM 1024 CA GLU A 67 -8.119 -16.745 -5.516 1.00 0.00 C ATOM 1025 C GLU A 67 -8.544 -15.244 -5.579 1.00 0.00 C ATOM 1026 O GLU A 67 -7.736 -14.339 -5.340 1.00 0.00 O ATOM 1027 CB GLU A 67 -8.194 -17.324 -4.068 1.00 0.00 C ATOM 1028 CG GLU A 67 -9.565 -17.314 -3.348 1.00 0.00 C ATOM 1029 CD GLU A 67 -10.663 -18.138 -4.027 1.00 0.00 C ATOM 1030 OE1 GLU A 67 -10.589 -19.387 -3.998 1.00 0.00 O ATOM 1031 OE2 GLU A 67 -11.607 -17.541 -4.591 1.00 0.00 O ATOM 0 H GLU A 67 -6.054 -17.076 -5.224 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.826 -17.254 -6.171 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.843 -18.355 -4.103 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -7.489 -16.768 -3.450 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.427 -17.687 -2.333 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.906 -16.282 -3.264 1.00 0.00 H new ATOM 1038 N GLU A 68 -9.847 -15.013 -5.847 1.00 0.00 N ATOM 1039 CA GLU A 68 -10.480 -13.671 -5.727 1.00 0.00 C ATOM 1040 C GLU A 68 -10.761 -13.318 -4.233 1.00 0.00 C ATOM 1041 O GLU A 68 -11.738 -13.780 -3.635 1.00 0.00 O ATOM 1042 CB GLU A 68 -11.697 -13.509 -6.679 1.00 0.00 C ATOM 1043 CG GLU A 68 -12.882 -14.474 -6.490 1.00 0.00 C ATOM 1044 CD GLU A 68 -14.070 -14.150 -7.398 1.00 0.00 C ATOM 1045 OE1 GLU A 68 -14.037 -14.518 -8.593 1.00 0.00 O ATOM 1046 OE2 GLU A 68 -15.043 -13.525 -6.921 1.00 0.00 O ATOM 0 H GLU A 68 -10.491 -15.743 -6.151 1.00 0.00 H new ATOM 0 HA GLU A 68 -9.771 -12.919 -6.074 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -12.072 -12.491 -6.574 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -11.339 -13.613 -7.703 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -12.548 -15.493 -6.688 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -13.207 -14.441 -5.450 1.00 0.00 H new ATOM 1053 N CYS A 69 -9.853 -12.529 -3.633 1.00 0.00 N ATOM 1054 CA CYS A 69 -9.891 -12.211 -2.181 1.00 0.00 C ATOM 1055 C CYS A 69 -10.538 -10.826 -1.929 1.00 0.00 C ATOM 1056 O CYS A 69 -10.284 -9.864 -2.663 1.00 0.00 O ATOM 1057 CB CYS A 69 -8.460 -12.244 -1.611 1.00 0.00 C ATOM 1058 SG CYS A 69 -7.648 -13.845 -1.951 1.00 0.00 S ATOM 0 H CYS A 69 -9.076 -12.093 -4.129 1.00 0.00 H new ATOM 0 HA CYS A 69 -10.501 -12.960 -1.676 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -7.873 -11.436 -2.048 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -8.490 -12.070 -0.535 1.00 0.00 H new ATOM 0 HG CYS A 69 -7.661 -14.075 -3.230 1.00 0.00 H new ATOM 1064 N GLU A 70 -11.349 -10.737 -0.859 1.00 0.00 N ATOM 1065 CA GLU A 70 -12.020 -9.471 -0.448 1.00 0.00 C ATOM 1066 C GLU A 70 -11.036 -8.576 0.359 1.00 0.00 C ATOM 1067 O GLU A 70 -10.567 -8.972 1.430 1.00 0.00 O ATOM 1068 CB GLU A 70 -13.396 -9.729 0.224 1.00 0.00 C ATOM 1069 CG GLU A 70 -13.423 -10.400 1.609 1.00 0.00 C ATOM 1070 CD GLU A 70 -13.502 -9.436 2.802 1.00 0.00 C ATOM 1071 OE1 GLU A 70 -14.555 -8.786 2.984 1.00 0.00 O ATOM 1072 OE2 GLU A 70 -12.517 -9.328 3.565 1.00 0.00 O ATOM 0 H GLU A 70 -11.562 -11.529 -0.253 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.278 -8.893 -1.335 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -13.908 -8.770 0.310 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.986 -10.345 -0.454 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -14.278 -11.075 1.651 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -12.527 -11.012 1.716 1.00 0.00 H new ATOM 1079 N LEU A 71 -10.680 -7.409 -0.209 1.00 0.00 N ATOM 1080 CA LEU A 71 -9.533 -6.593 0.277 1.00 0.00 C ATOM 1081 C LEU A 71 -9.975 -5.116 0.389 1.00 0.00 C ATOM 1082 O LEU A 71 -10.384 -4.498 -0.603 1.00 0.00 O ATOM 1083 CB LEU A 71 -8.296 -6.703 -0.665 1.00 0.00 C ATOM 1084 CG LEU A 71 -7.709 -8.116 -0.932 1.00 0.00 C ATOM 1085 CD1 LEU A 71 -6.625 -8.048 -2.026 1.00 0.00 C ATOM 1086 CD2 LEU A 71 -7.205 -8.840 0.336 1.00 0.00 C ATOM 0 H LEU A 71 -11.167 -7.002 -1.008 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.234 -6.976 1.253 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -8.568 -6.267 -1.626 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -7.502 -6.084 -0.247 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.535 -8.731 -1.291 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.223 -9.046 -2.202 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.062 -7.665 -2.948 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.822 -7.385 -1.702 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.811 -9.819 0.064 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.417 -8.249 0.804 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -8.031 -8.963 1.037 1.00 0.00 H new ATOM 1098 N GLU A 72 -9.833 -4.546 1.601 1.00 0.00 N ATOM 1099 CA GLU A 72 -10.136 -3.118 1.869 1.00 0.00 C ATOM 1100 C GLU A 72 -9.076 -2.193 1.197 1.00 0.00 C ATOM 1101 O GLU A 72 -7.864 -2.396 1.330 1.00 0.00 O ATOM 1102 CB GLU A 72 -10.264 -2.900 3.398 1.00 0.00 C ATOM 1103 CG GLU A 72 -10.773 -1.502 3.815 1.00 0.00 C ATOM 1104 CD GLU A 72 -10.949 -1.348 5.328 1.00 0.00 C ATOM 1105 OE1 GLU A 72 -11.864 -1.984 5.898 1.00 0.00 O ATOM 1106 OE2 GLU A 72 -10.185 -0.580 5.953 1.00 0.00 O ATOM 0 H GLU A 72 -9.507 -5.056 2.422 1.00 0.00 H new ATOM 0 HA GLU A 72 -11.092 -2.846 1.422 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -10.941 -3.653 3.802 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -9.290 -3.068 3.857 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -10.072 -0.747 3.459 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -11.727 -1.309 3.324 1.00 0.00 H new ATOM 1113 N THR A 73 -9.580 -1.194 0.454 1.00 0.00 N ATOM 1114 CA THR A 73 -8.750 -0.312 -0.410 1.00 0.00 C ATOM 1115 C THR A 73 -8.093 0.805 0.461 1.00 0.00 C ATOM 1116 O THR A 73 -6.907 0.684 0.786 1.00 0.00 O ATOM 1117 CB THR A 73 -9.614 0.146 -1.629 1.00 0.00 C ATOM 1118 OG1 THR A 73 -10.092 -0.989 -2.352 1.00 0.00 O ATOM 1119 CG2 THR A 73 -8.870 1.033 -2.638 1.00 0.00 C ATOM 0 H THR A 73 -10.574 -0.968 0.430 1.00 0.00 H new ATOM 0 HA THR A 73 -7.897 -0.826 -0.853 1.00 0.00 H new ATOM 0 HB THR A 73 -10.421 0.732 -1.189 1.00 0.00 H new ATOM 0 HG1 THR A 73 -10.838 -1.397 -1.864 1.00 0.00 H new ATOM 0 HG21 THR A 73 -9.544 1.304 -3.451 1.00 0.00 H new ATOM 0 HG22 THR A 73 -8.521 1.937 -2.139 1.00 0.00 H new ATOM 0 HG23 THR A 73 -8.016 0.488 -3.041 1.00 0.00 H new ATOM 1127 N MET A 74 -8.849 1.849 0.858 1.00 0.00 N ATOM 1128 CA MET A 74 -8.365 2.894 1.803 1.00 0.00 C ATOM 1129 C MET A 74 -9.571 3.375 2.658 1.00 0.00 C ATOM 1130 O MET A 74 -10.262 4.341 2.323 1.00 0.00 O ATOM 1131 CB MET A 74 -7.527 4.014 1.128 1.00 0.00 C ATOM 1132 CG MET A 74 -8.184 4.771 -0.036 1.00 0.00 C ATOM 1133 SD MET A 74 -7.018 5.946 -0.767 1.00 0.00 S ATOM 1134 CE MET A 74 -6.054 4.889 -1.872 1.00 0.00 C ATOM 0 H MET A 74 -9.806 1.997 0.539 1.00 0.00 H new ATOM 0 HA MET A 74 -7.630 2.463 2.483 1.00 0.00 H new ATOM 0 HB2 MET A 74 -7.254 4.740 1.893 1.00 0.00 H new ATOM 0 HB3 MET A 74 -6.600 3.571 0.764 1.00 0.00 H new ATOM 0 HG2 MET A 74 -8.520 4.063 -0.794 1.00 0.00 H new ATOM 0 HG3 MET A 74 -9.068 5.300 0.320 1.00 0.00 H new ATOM 0 HE1 MET A 74 -5.033 5.266 -1.937 1.00 0.00 H new ATOM 0 HE2 MET A 74 -6.041 3.871 -1.482 1.00 0.00 H new ATOM 0 HE3 MET A 74 -6.505 4.892 -2.864 1.00 0.00 H new ATOM 1144 N THR A 75 -9.823 2.646 3.765 1.00 0.00 N ATOM 1145 CA THR A 75 -10.957 2.871 4.703 1.00 0.00 C ATOM 1146 C THR A 75 -12.337 2.599 4.018 1.00 0.00 C ATOM 1147 O THR A 75 -12.945 3.482 3.404 1.00 0.00 O ATOM 1148 CB THR A 75 -10.907 4.213 5.491 1.00 0.00 C ATOM 1149 OG1 THR A 75 -9.578 4.530 5.900 1.00 0.00 O ATOM 1150 CG2 THR A 75 -11.787 4.231 6.752 1.00 0.00 C ATOM 0 H THR A 75 -9.232 1.863 4.044 1.00 0.00 H new ATOM 0 HA THR A 75 -10.834 2.123 5.486 1.00 0.00 H new ATOM 0 HB THR A 75 -11.291 4.950 4.786 1.00 0.00 H new ATOM 0 HG1 THR A 75 -9.580 5.378 6.390 1.00 0.00 H new ATOM 0 HG21 THR A 75 -11.697 5.199 7.244 1.00 0.00 H new ATOM 0 HG22 THR A 75 -12.827 4.061 6.473 1.00 0.00 H new ATOM 0 HG23 THR A 75 -11.462 3.446 7.434 1.00 0.00 H new ATOM 1158 N GLY A 76 -12.796 1.355 4.161 1.00 0.00 N ATOM 1159 CA GLY A 76 -14.163 0.935 3.783 1.00 0.00 C ATOM 1160 C GLY A 76 -14.502 0.750 2.285 1.00 0.00 C ATOM 1161 O GLY A 76 -15.492 1.333 1.835 1.00 0.00 O ATOM 0 H GLY A 76 -12.231 0.597 4.545 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -14.368 -0.010 4.286 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -14.858 1.670 4.190 1.00 0.00 H new ATOM 1165 N GLU A 77 -13.767 -0.107 1.543 1.00 0.00 N ATOM 1166 CA GLU A 77 -14.255 -0.657 0.249 1.00 0.00 C ATOM 1167 C GLU A 77 -13.584 -2.036 0.008 1.00 0.00 C ATOM 1168 O GLU A 77 -12.432 -2.118 -0.428 1.00 0.00 O ATOM 1169 CB GLU A 77 -14.057 0.327 -0.940 1.00 0.00 C ATOM 1170 CG GLU A 77 -14.583 -0.163 -2.311 1.00 0.00 C ATOM 1171 CD GLU A 77 -16.082 -0.482 -2.378 1.00 0.00 C ATOM 1172 OE1 GLU A 77 -16.901 0.460 -2.452 1.00 0.00 O ATOM 1173 OE2 GLU A 77 -16.445 -1.679 -2.353 1.00 0.00 O ATOM 0 H GLU A 77 -12.839 -0.434 1.811 1.00 0.00 H new ATOM 0 HA GLU A 77 -15.334 -0.795 0.310 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -14.552 1.267 -0.696 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -12.993 0.543 -1.036 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -14.360 0.599 -3.058 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -14.028 -1.058 -2.593 1.00 0.00 H new ATOM 1180 N LYS A 78 -14.357 -3.107 0.256 1.00 0.00 N ATOM 1181 CA LYS A 78 -13.898 -4.513 0.089 1.00 0.00 C ATOM 1182 C LYS A 78 -14.396 -5.056 -1.275 1.00 0.00 C ATOM 1183 O LYS A 78 -15.593 -5.013 -1.579 1.00 0.00 O ATOM 1184 CB LYS A 78 -14.372 -5.418 1.261 1.00 0.00 C ATOM 1185 CG LYS A 78 -13.538 -5.315 2.565 1.00 0.00 C ATOM 1186 CD LYS A 78 -14.259 -4.762 3.810 1.00 0.00 C ATOM 1187 CE LYS A 78 -14.562 -3.253 3.758 1.00 0.00 C ATOM 1188 NZ LYS A 78 -15.116 -2.772 5.035 1.00 0.00 N ATOM 0 H LYS A 78 -15.321 -3.031 0.579 1.00 0.00 H new ATOM 0 HA LYS A 78 -12.808 -4.527 0.105 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -15.408 -5.170 1.493 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -14.360 -6.455 0.924 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -13.159 -6.308 2.805 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -12.672 -4.683 2.365 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -15.196 -5.303 3.941 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -13.647 -4.966 4.689 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -13.649 -2.705 3.526 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -15.269 -3.050 2.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -15.435 -1.788 4.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -15.922 -3.369 5.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -14.383 -2.819 5.771 1.00 0.00 H new ATOM 1202 N VAL A 79 -13.447 -5.558 -2.087 1.00 0.00 N ATOM 1203 CA VAL A 79 -13.712 -5.989 -3.487 1.00 0.00 C ATOM 1204 C VAL A 79 -13.044 -7.385 -3.652 1.00 0.00 C ATOM 1205 O VAL A 79 -11.833 -7.521 -3.444 1.00 0.00 O ATOM 1206 CB VAL A 79 -13.169 -4.960 -4.544 1.00 0.00 C ATOM 1207 CG1 VAL A 79 -13.545 -5.350 -5.992 1.00 0.00 C ATOM 1208 CG2 VAL A 79 -13.624 -3.498 -4.318 1.00 0.00 C ATOM 0 H VAL A 79 -12.476 -5.679 -1.800 1.00 0.00 H new ATOM 0 HA VAL A 79 -14.785 -6.042 -3.670 1.00 0.00 H new ATOM 0 HB VAL A 79 -12.090 -5.006 -4.400 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -13.147 -4.608 -6.684 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -13.124 -6.328 -6.227 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -14.630 -5.390 -6.088 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -13.201 -2.861 -5.095 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -14.712 -3.445 -4.358 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -13.280 -3.157 -3.342 1.00 0.00 H new ATOM 1218 N LYS A 80 -13.822 -8.392 -4.105 1.00 0.00 N ATOM 1219 CA LYS A 80 -13.271 -9.718 -4.511 1.00 0.00 C ATOM 1220 C LYS A 80 -12.529 -9.585 -5.872 1.00 0.00 C ATOM 1221 O LYS A 80 -13.151 -9.403 -6.924 1.00 0.00 O ATOM 1222 CB LYS A 80 -14.368 -10.814 -4.568 1.00 0.00 C ATOM 1223 CG LYS A 80 -14.864 -11.288 -3.185 1.00 0.00 C ATOM 1224 CD LYS A 80 -15.906 -12.425 -3.266 1.00 0.00 C ATOM 1225 CE LYS A 80 -16.364 -12.975 -1.899 1.00 0.00 C ATOM 1226 NZ LYS A 80 -17.182 -12.020 -1.126 1.00 0.00 N ATOM 0 H LYS A 80 -14.835 -8.319 -4.201 1.00 0.00 H new ATOM 0 HA LYS A 80 -12.558 -10.037 -3.750 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -15.217 -10.432 -5.135 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -13.979 -11.673 -5.116 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -14.011 -11.628 -2.598 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -15.300 -10.442 -2.654 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -16.779 -12.062 -3.808 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -15.486 -13.244 -3.850 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -16.938 -13.888 -2.057 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -15.486 -13.247 -1.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -17.456 -12.451 -0.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -16.630 -11.157 -0.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -18.037 -11.778 -1.667 1.00 0.00 H new ATOM 1240 N THR A 81 -11.187 -9.622 -5.801 1.00 0.00 N ATOM 1241 CA THR A 81 -10.295 -9.280 -6.938 1.00 0.00 C ATOM 1242 C THR A 81 -9.063 -10.229 -6.916 1.00 0.00 C ATOM 1243 O THR A 81 -8.452 -10.464 -5.864 1.00 0.00 O ATOM 1244 CB THR A 81 -9.938 -7.761 -6.936 1.00 0.00 C ATOM 1245 OG1 THR A 81 -9.257 -7.447 -8.142 1.00 0.00 O ATOM 1246 CG2 THR A 81 -9.096 -7.232 -5.754 1.00 0.00 C ATOM 0 H THR A 81 -10.683 -9.889 -4.955 1.00 0.00 H new ATOM 0 HA THR A 81 -10.806 -9.442 -7.887 1.00 0.00 H new ATOM 0 HB THR A 81 -10.903 -7.264 -6.833 1.00 0.00 H new ATOM 0 HG1 THR A 81 -8.291 -7.431 -7.977 1.00 0.00 H new ATOM 0 HG21 THR A 81 -8.922 -6.163 -5.880 1.00 0.00 H new ATOM 0 HG22 THR A 81 -9.631 -7.405 -4.820 1.00 0.00 H new ATOM 0 HG23 THR A 81 -8.140 -7.754 -5.726 1.00 0.00 H new ATOM 1254 N VAL A 82 -8.697 -10.764 -8.097 1.00 0.00 N ATOM 1255 CA VAL A 82 -7.603 -11.765 -8.232 1.00 0.00 C ATOM 1256 C VAL A 82 -6.259 -10.988 -8.308 1.00 0.00 C ATOM 1257 O VAL A 82 -6.034 -10.205 -9.238 1.00 0.00 O ATOM 1258 CB VAL A 82 -7.792 -12.725 -9.460 1.00 0.00 C ATOM 1259 CG1 VAL A 82 -6.679 -13.800 -9.545 1.00 0.00 C ATOM 1260 CG2 VAL A 82 -9.148 -13.467 -9.477 1.00 0.00 C ATOM 0 H VAL A 82 -9.143 -10.522 -8.982 1.00 0.00 H new ATOM 0 HA VAL A 82 -7.614 -12.423 -7.363 1.00 0.00 H new ATOM 0 HB VAL A 82 -7.746 -12.053 -10.317 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -6.855 -14.438 -10.411 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -5.709 -13.313 -9.645 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -6.689 -14.406 -8.639 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -9.200 -14.109 -10.356 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -9.241 -14.075 -8.577 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -9.960 -12.740 -9.510 1.00 0.00 H new ATOM 1270 N VAL A 83 -5.366 -11.269 -7.344 1.00 0.00 N ATOM 1271 CA VAL A 83 -3.960 -10.791 -7.396 1.00 0.00 C ATOM 1272 C VAL A 83 -3.134 -11.943 -8.033 1.00 0.00 C ATOM 1273 O VAL A 83 -3.058 -13.037 -7.467 1.00 0.00 O ATOM 1274 CB VAL A 83 -3.377 -10.343 -6.013 1.00 0.00 C ATOM 1275 CG1 VAL A 83 -2.044 -9.587 -6.229 1.00 0.00 C ATOM 1276 CG2 VAL A 83 -4.314 -9.469 -5.143 1.00 0.00 C ATOM 0 H VAL A 83 -5.586 -11.824 -6.517 1.00 0.00 H new ATOM 0 HA VAL A 83 -3.910 -9.880 -7.992 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.237 -11.270 -5.456 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.641 -9.277 -5.265 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -1.330 -10.243 -6.726 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -2.221 -8.708 -6.848 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.812 -9.216 -4.209 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -4.562 -8.554 -5.681 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.228 -10.021 -4.925 1.00 0.00 H new ATOM 1286 N GLN A 84 -2.527 -11.677 -9.203 1.00 0.00 N ATOM 1287 CA GLN A 84 -1.650 -12.658 -9.897 1.00 0.00 C ATOM 1288 C GLN A 84 -0.171 -12.207 -9.819 1.00 0.00 C ATOM 1289 O GLN A 84 0.161 -11.026 -9.949 1.00 0.00 O ATOM 1290 CB GLN A 84 -2.114 -12.877 -11.357 1.00 0.00 C ATOM 1291 CG GLN A 84 -1.559 -14.126 -12.090 1.00 0.00 C ATOM 1292 CD GLN A 84 -1.857 -15.483 -11.420 1.00 0.00 C ATOM 1293 OE1 GLN A 84 -1.006 -16.056 -10.738 1.00 0.00 O ATOM 1294 NE2 GLN A 84 -3.058 -16.020 -11.582 1.00 0.00 N ATOM 0 H GLN A 84 -2.624 -10.789 -9.696 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.728 -13.620 -9.390 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -3.202 -12.937 -11.362 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -1.841 -11.995 -11.936 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -1.968 -14.143 -13.100 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -0.479 -14.018 -12.185 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -3.759 -15.541 -12.148 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -3.281 -16.912 -11.141 1.00 0.00 H new ATOM 1303 N LEU A 85 0.706 -13.202 -9.644 1.00 0.00 N ATOM 1304 CA LEU A 85 2.168 -13.001 -9.555 1.00 0.00 C ATOM 1305 C LEU A 85 2.792 -13.371 -10.928 1.00 0.00 C ATOM 1306 O LEU A 85 2.831 -14.547 -11.305 1.00 0.00 O ATOM 1307 CB LEU A 85 2.704 -13.843 -8.362 1.00 0.00 C ATOM 1308 CG LEU A 85 4.233 -13.796 -8.118 1.00 0.00 C ATOM 1309 CD1 LEU A 85 4.768 -12.374 -7.862 1.00 0.00 C ATOM 1310 CD2 LEU A 85 4.643 -14.739 -6.969 1.00 0.00 C ATOM 0 H LEU A 85 0.425 -14.179 -9.559 1.00 0.00 H new ATOM 0 HA LEU A 85 2.442 -11.965 -9.354 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.203 -13.507 -7.454 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.415 -14.882 -8.520 1.00 0.00 H new ATOM 0 HG LEU A 85 4.692 -14.141 -9.044 1.00 0.00 H new ATOM 0 HD11 LEU A 85 5.845 -12.414 -7.699 1.00 0.00 H new ATOM 0 HD12 LEU A 85 4.555 -11.744 -8.726 1.00 0.00 H new ATOM 0 HD13 LEU A 85 4.283 -11.956 -6.980 1.00 0.00 H new ATOM 0 HD21 LEU A 85 5.722 -14.685 -6.821 1.00 0.00 H new ATOM 0 HD22 LEU A 85 4.135 -14.438 -6.053 1.00 0.00 H new ATOM 0 HD23 LEU A 85 4.362 -15.762 -7.220 1.00 0.00 H new ATOM 1322 N GLU A 86 3.280 -12.346 -11.650 1.00 0.00 N ATOM 1323 CA GLU A 86 3.946 -12.517 -12.965 1.00 0.00 C ATOM 1324 C GLU A 86 5.459 -12.215 -12.781 1.00 0.00 C ATOM 1325 O GLU A 86 5.871 -11.112 -12.404 1.00 0.00 O ATOM 1326 CB GLU A 86 3.282 -11.593 -14.017 1.00 0.00 C ATOM 1327 CG GLU A 86 3.538 -11.915 -15.508 1.00 0.00 C ATOM 1328 CD GLU A 86 4.941 -11.570 -16.025 1.00 0.00 C ATOM 1329 OE1 GLU A 86 5.267 -10.368 -16.136 1.00 0.00 O ATOM 1330 OE2 GLU A 86 5.723 -12.501 -16.321 1.00 0.00 O ATOM 0 H GLU A 86 3.226 -11.375 -11.343 1.00 0.00 H new ATOM 0 HA GLU A 86 3.837 -13.538 -13.332 1.00 0.00 H new ATOM 0 HB2 GLU A 86 2.205 -11.610 -13.849 1.00 0.00 H new ATOM 0 HB3 GLU A 86 3.618 -10.573 -13.830 1.00 0.00 H new ATOM 0 HG2 GLU A 86 3.362 -12.979 -15.668 1.00 0.00 H new ATOM 0 HG3 GLU A 86 2.805 -11.377 -16.109 1.00 0.00 H new ATOM 1337 N GLY A 87 6.262 -13.239 -13.078 1.00 0.00 N ATOM 1338 CA GLY A 87 7.745 -13.155 -13.044 1.00 0.00 C ATOM 1339 C GLY A 87 8.496 -13.068 -11.693 1.00 0.00 C ATOM 1340 O GLY A 87 9.671 -12.692 -11.686 1.00 0.00 O ATOM 0 H GLY A 87 5.913 -14.158 -13.351 1.00 0.00 H new ATOM 0 HA2 GLY A 87 8.129 -14.029 -13.570 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.031 -12.280 -13.628 1.00 0.00 H new ATOM 1344 N ASP A 88 7.820 -13.373 -10.572 1.00 0.00 N ATOM 1345 CA ASP A 88 8.315 -13.106 -9.186 1.00 0.00 C ATOM 1346 C ASP A 88 8.454 -11.599 -8.743 1.00 0.00 C ATOM 1347 O ASP A 88 8.847 -11.351 -7.600 1.00 0.00 O ATOM 1348 CB ASP A 88 9.535 -14.009 -8.819 1.00 0.00 C ATOM 1349 CG ASP A 88 9.766 -14.236 -7.315 1.00 0.00 C ATOM 1350 OD1 ASP A 88 8.909 -14.869 -6.658 1.00 0.00 O ATOM 1351 OD2 ASP A 88 10.802 -13.776 -6.785 1.00 0.00 O ATOM 0 H ASP A 88 6.902 -13.818 -10.590 1.00 0.00 H new ATOM 0 HA ASP A 88 7.483 -13.413 -8.552 1.00 0.00 H new ATOM 0 HB2 ASP A 88 9.403 -14.979 -9.298 1.00 0.00 H new ATOM 0 HB3 ASP A 88 10.435 -13.563 -9.243 1.00 0.00 H new ATOM 1356 N ASN A 89 8.111 -10.603 -9.593 1.00 0.00 N ATOM 1357 CA ASN A 89 8.165 -9.155 -9.233 1.00 0.00 C ATOM 1358 C ASN A 89 6.999 -8.287 -9.816 1.00 0.00 C ATOM 1359 O ASN A 89 7.227 -7.107 -10.091 1.00 0.00 O ATOM 1360 CB ASN A 89 9.586 -8.572 -9.521 1.00 0.00 C ATOM 1361 CG ASN A 89 9.998 -8.376 -11.000 1.00 0.00 C ATOM 1362 OD1 ASN A 89 10.124 -9.333 -11.763 1.00 0.00 O ATOM 1363 ND2 ASN A 89 10.218 -7.142 -11.431 1.00 0.00 N ATOM 0 H ASN A 89 7.789 -10.773 -10.546 1.00 0.00 H new ATOM 0 HA ASN A 89 7.992 -9.098 -8.158 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.659 -7.606 -9.022 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.319 -9.229 -9.053 1.00 0.00 H new ATOM 0 HD21 ASN A 89 10.493 -6.982 -12.400 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.112 -6.353 -10.794 1.00 0.00 H new ATOM 1370 N LYS A 90 5.759 -8.804 -9.970 1.00 0.00 N ATOM 1371 CA LYS A 90 4.588 -7.998 -10.425 1.00 0.00 C ATOM 1372 C LYS A 90 3.312 -8.616 -9.790 1.00 0.00 C ATOM 1373 O LYS A 90 2.829 -9.653 -10.255 1.00 0.00 O ATOM 1374 CB LYS A 90 4.432 -7.935 -11.975 1.00 0.00 C ATOM 1375 CG LYS A 90 5.485 -7.113 -12.750 1.00 0.00 C ATOM 1376 CD LYS A 90 5.267 -7.047 -14.277 1.00 0.00 C ATOM 1377 CE LYS A 90 4.093 -6.149 -14.714 1.00 0.00 C ATOM 1378 NZ LYS A 90 3.973 -6.097 -16.181 1.00 0.00 N ATOM 0 H LYS A 90 5.536 -9.782 -9.786 1.00 0.00 H new ATOM 0 HA LYS A 90 4.745 -6.969 -10.103 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.448 -8.955 -12.359 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.448 -7.524 -12.201 1.00 0.00 H new ATOM 0 HG2 LYS A 90 5.493 -6.097 -12.355 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.470 -7.538 -12.557 1.00 0.00 H new ATOM 0 HD2 LYS A 90 6.181 -6.684 -14.747 1.00 0.00 H new ATOM 0 HD3 LYS A 90 5.096 -8.056 -14.651 1.00 0.00 H new ATOM 0 HE2 LYS A 90 3.165 -6.526 -14.285 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.238 -5.142 -14.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 3.174 -5.485 -16.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 4.850 -5.714 -16.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.810 -7.056 -16.550 1.00 0.00 H new ATOM 1392 N LEU A 91 2.751 -7.961 -8.754 1.00 0.00 N ATOM 1393 CA LEU A 91 1.454 -8.369 -8.142 1.00 0.00 C ATOM 1394 C LEU A 91 0.338 -7.464 -8.735 1.00 0.00 C ATOM 1395 O LEU A 91 0.217 -6.289 -8.373 1.00 0.00 O ATOM 1396 CB LEU A 91 1.527 -8.317 -6.589 1.00 0.00 C ATOM 1397 CG LEU A 91 2.393 -9.413 -5.903 1.00 0.00 C ATOM 1398 CD1 LEU A 91 2.693 -9.049 -4.436 1.00 0.00 C ATOM 1399 CD2 LEU A 91 1.762 -10.819 -5.967 1.00 0.00 C ATOM 0 H LEU A 91 3.172 -7.142 -8.316 1.00 0.00 H new ATOM 0 HA LEU A 91 1.222 -9.406 -8.383 1.00 0.00 H new ATOM 0 HB2 LEU A 91 1.916 -7.341 -6.297 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.513 -8.387 -6.196 1.00 0.00 H new ATOM 0 HG LEU A 91 3.323 -9.448 -6.470 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.300 -9.833 -3.983 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.235 -8.104 -4.399 1.00 0.00 H new ATOM 0 HD13 LEU A 91 1.757 -8.952 -3.886 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.417 -11.535 -5.470 1.00 0.00 H new ATOM 0 HD22 LEU A 91 0.793 -10.806 -5.467 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.629 -11.111 -7.009 1.00 0.00 H new ATOM 1411 N VAL A 92 -0.438 -8.022 -9.686 1.00 0.00 N ATOM 1412 CA VAL A 92 -1.337 -7.241 -10.586 1.00 0.00 C ATOM 1413 C VAL A 92 -2.821 -7.510 -10.206 1.00 0.00 C ATOM 1414 O VAL A 92 -3.255 -8.668 -10.189 1.00 0.00 O ATOM 1415 CB VAL A 92 -1.041 -7.514 -12.104 1.00 0.00 C ATOM 1416 CG1 VAL A 92 0.346 -6.985 -12.533 1.00 0.00 C ATOM 1417 CG2 VAL A 92 -1.182 -8.980 -12.586 1.00 0.00 C ATOM 0 H VAL A 92 -0.465 -9.027 -9.859 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.138 -6.179 -10.440 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.841 -6.958 -12.593 1.00 0.00 H new ATOM 0 HG11 VAL A 92 0.505 -7.197 -13.590 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.392 -5.909 -12.368 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.121 -7.476 -11.944 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.952 -9.037 -13.650 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.491 -9.614 -12.031 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.203 -9.322 -12.417 1.00 0.00 H new ATOM 1427 N THR A 93 -3.597 -6.445 -9.909 1.00 0.00 N ATOM 1428 CA THR A 93 -5.025 -6.591 -9.496 1.00 0.00 C ATOM 1429 C THR A 93 -5.856 -5.342 -9.906 1.00 0.00 C ATOM 1430 O THR A 93 -5.494 -4.211 -9.571 1.00 0.00 O ATOM 1431 CB THR A 93 -5.153 -6.949 -7.985 1.00 0.00 C ATOM 1432 OG1 THR A 93 -6.486 -7.349 -7.706 1.00 0.00 O ATOM 1433 CG2 THR A 93 -4.752 -5.862 -6.968 1.00 0.00 C ATOM 0 H THR A 93 -3.270 -5.480 -9.945 1.00 0.00 H new ATOM 0 HA THR A 93 -5.452 -7.436 -10.037 1.00 0.00 H new ATOM 0 HB THR A 93 -4.424 -7.747 -7.846 1.00 0.00 H new ATOM 0 HG1 THR A 93 -6.477 -8.108 -7.086 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.889 -6.242 -5.956 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.706 -5.593 -7.116 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.377 -4.981 -7.112 1.00 0.00 H new ATOM 1441 N THR A 94 -6.999 -5.569 -10.580 1.00 0.00 N ATOM 1442 CA THR A 94 -7.951 -4.485 -10.954 1.00 0.00 C ATOM 1443 C THR A 94 -9.159 -4.557 -9.980 1.00 0.00 C ATOM 1444 O THR A 94 -9.964 -5.493 -10.045 1.00 0.00 O ATOM 1445 CB THR A 94 -8.356 -4.567 -12.457 1.00 0.00 C ATOM 1446 OG1 THR A 94 -7.193 -4.554 -13.279 1.00 0.00 O ATOM 1447 CG2 THR A 94 -9.241 -3.395 -12.927 1.00 0.00 C ATOM 0 H THR A 94 -7.295 -6.497 -10.882 1.00 0.00 H new ATOM 0 HA THR A 94 -7.479 -3.508 -10.852 1.00 0.00 H new ATOM 0 HB THR A 94 -8.923 -5.494 -12.550 1.00 0.00 H new ATOM 0 HG1 THR A 94 -7.458 -4.608 -14.221 1.00 0.00 H new ATOM 0 HG21 THR A 94 -9.482 -3.521 -13.983 1.00 0.00 H new ATOM 0 HG22 THR A 94 -10.162 -3.378 -12.344 1.00 0.00 H new ATOM 0 HG23 THR A 94 -8.706 -2.456 -12.787 1.00 0.00 H new ATOM 1455 N PHE A 95 -9.290 -3.539 -9.107 1.00 0.00 N ATOM 1456 CA PHE A 95 -10.407 -3.430 -8.124 1.00 0.00 C ATOM 1457 C PHE A 95 -11.753 -3.134 -8.857 1.00 0.00 C ATOM 1458 O PHE A 95 -12.533 -4.057 -9.106 1.00 0.00 O ATOM 1459 CB PHE A 95 -10.060 -2.424 -6.977 1.00 0.00 C ATOM 1460 CG PHE A 95 -8.909 -2.793 -6.018 1.00 0.00 C ATOM 1461 CD1 PHE A 95 -7.585 -2.484 -6.351 1.00 0.00 C ATOM 1462 CD2 PHE A 95 -9.181 -3.375 -4.773 1.00 0.00 C ATOM 1463 CE1 PHE A 95 -6.551 -2.757 -5.460 1.00 0.00 C ATOM 1464 CE2 PHE A 95 -8.145 -3.647 -3.881 1.00 0.00 C ATOM 1465 CZ PHE A 95 -6.831 -3.340 -4.228 1.00 0.00 C ATOM 0 H PHE A 95 -8.628 -2.764 -9.057 1.00 0.00 H new ATOM 0 HA PHE A 95 -10.544 -4.389 -7.625 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -9.819 -1.465 -7.435 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -10.959 -2.275 -6.379 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -7.364 -2.031 -7.306 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -10.199 -3.614 -4.503 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -5.532 -2.516 -5.725 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -8.361 -4.095 -2.922 1.00 0.00 H new ATOM 0 HZ PHE A 95 -6.028 -3.555 -3.539 1.00 0.00 H new ATOM 1475 N LYS A 96 -11.970 -1.869 -9.244 1.00 0.00 N ATOM 1476 CA LYS A 96 -13.084 -1.451 -10.139 1.00 0.00 C ATOM 1477 C LYS A 96 -12.434 -0.890 -11.438 1.00 0.00 C ATOM 1478 O LYS A 96 -12.393 -1.602 -12.445 1.00 0.00 O ATOM 1479 CB LYS A 96 -14.078 -0.486 -9.423 1.00 0.00 C ATOM 1480 CG LYS A 96 -14.822 -1.028 -8.180 1.00 0.00 C ATOM 1481 CD LYS A 96 -15.813 -2.176 -8.458 1.00 0.00 C ATOM 1482 CE LYS A 96 -16.533 -2.652 -7.184 1.00 0.00 C ATOM 1483 NZ LYS A 96 -17.453 -3.768 -7.466 1.00 0.00 N ATOM 0 H LYS A 96 -11.378 -1.093 -8.948 1.00 0.00 H new ATOM 0 HA LYS A 96 -13.721 -2.293 -10.411 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -13.526 0.405 -9.124 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -14.824 -0.169 -10.151 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.084 -1.374 -7.456 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -15.365 -0.206 -7.714 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -16.552 -1.845 -9.188 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -15.278 -3.014 -8.904 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -15.796 -2.965 -6.444 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -17.089 -1.822 -6.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -17.921 -4.063 -6.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -18.171 -3.461 -8.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -16.918 -4.568 -7.859 1.00 0.00 H new ATOM 1497 N ASN A 97 -11.884 0.341 -11.396 1.00 0.00 N ATOM 1498 CA ASN A 97 -10.919 0.851 -12.417 1.00 0.00 C ATOM 1499 C ASN A 97 -9.458 1.075 -11.882 1.00 0.00 C ATOM 1500 O ASN A 97 -8.612 1.521 -12.662 1.00 0.00 O ATOM 1501 CB ASN A 97 -11.498 2.158 -13.035 1.00 0.00 C ATOM 1502 CG ASN A 97 -12.744 1.985 -13.929 1.00 0.00 C ATOM 1503 OD1 ASN A 97 -13.879 2.092 -13.467 1.00 0.00 O ATOM 1504 ND2 ASN A 97 -12.561 1.716 -15.214 1.00 0.00 N ATOM 0 H ASN A 97 -12.090 1.015 -10.659 1.00 0.00 H new ATOM 0 HA ASN A 97 -10.812 0.076 -13.176 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -11.749 2.841 -12.223 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -10.715 2.636 -13.624 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -13.365 1.596 -15.829 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -11.616 1.629 -15.587 1.00 0.00 H new ATOM 1511 N ILE A 98 -9.130 0.744 -10.609 1.00 0.00 N ATOM 1512 CA ILE A 98 -7.778 0.942 -10.015 1.00 0.00 C ATOM 1513 C ILE A 98 -6.949 -0.323 -10.390 1.00 0.00 C ATOM 1514 O ILE A 98 -7.078 -1.362 -9.735 1.00 0.00 O ATOM 1515 CB ILE A 98 -7.861 1.196 -8.459 1.00 0.00 C ATOM 1516 CG1 ILE A 98 -8.640 2.478 -8.019 1.00 0.00 C ATOM 1517 CG2 ILE A 98 -6.452 1.268 -7.812 1.00 0.00 C ATOM 1518 CD1 ILE A 98 -10.175 2.388 -8.037 1.00 0.00 C ATOM 0 H ILE A 98 -9.798 0.329 -9.959 1.00 0.00 H new ATOM 0 HA ILE A 98 -7.291 1.834 -10.409 1.00 0.00 H new ATOM 0 HB ILE A 98 -8.426 0.333 -8.108 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -8.325 2.738 -7.008 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -8.339 3.300 -8.668 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -6.552 1.444 -6.741 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -5.927 0.327 -7.978 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -5.886 2.084 -8.262 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -10.599 3.338 -7.712 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -10.515 2.166 -9.049 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -10.501 1.596 -7.363 1.00 0.00 H new ATOM 1530 N LYS A 99 -6.091 -0.217 -11.422 1.00 0.00 N ATOM 1531 CA LYS A 99 -5.224 -1.343 -11.865 1.00 0.00 C ATOM 1532 C LYS A 99 -3.853 -1.226 -11.144 1.00 0.00 C ATOM 1533 O LYS A 99 -2.935 -0.563 -11.633 1.00 0.00 O ATOM 1534 CB LYS A 99 -5.158 -1.328 -13.414 1.00 0.00 C ATOM 1535 CG LYS A 99 -4.388 -2.511 -14.047 1.00 0.00 C ATOM 1536 CD LYS A 99 -4.301 -2.502 -15.590 1.00 0.00 C ATOM 1537 CE LYS A 99 -5.552 -2.979 -16.359 1.00 0.00 C ATOM 1538 NZ LYS A 99 -6.625 -1.970 -16.438 1.00 0.00 N ATOM 0 H LYS A 99 -5.974 0.635 -11.970 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.622 -2.320 -11.590 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.175 -1.325 -13.806 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.690 -0.397 -13.734 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -3.375 -2.519 -13.644 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -4.864 -3.440 -13.733 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -4.071 -1.486 -15.912 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -3.460 -3.129 -15.887 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -5.259 -3.263 -17.370 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -5.944 -3.875 -15.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -7.217 -2.157 -17.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -7.211 -2.018 -15.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -6.205 -1.022 -16.517 1.00 0.00 H new ATOM 1552 N SER A 100 -3.746 -1.879 -9.970 1.00 0.00 N ATOM 1553 CA SER A 100 -2.570 -1.779 -9.073 1.00 0.00 C ATOM 1554 C SER A 100 -1.463 -2.770 -9.513 1.00 0.00 C ATOM 1555 O SER A 100 -1.495 -3.956 -9.169 1.00 0.00 O ATOM 1556 CB SER A 100 -3.053 -2.032 -7.625 1.00 0.00 C ATOM 1557 OG SER A 100 -2.011 -1.780 -6.690 1.00 0.00 O ATOM 0 H SER A 100 -4.476 -2.495 -9.612 1.00 0.00 H new ATOM 0 HA SER A 100 -2.124 -0.786 -9.126 1.00 0.00 H new ATOM 0 HB2 SER A 100 -3.907 -1.391 -7.405 1.00 0.00 H new ATOM 0 HB3 SER A 100 -3.394 -3.063 -7.526 1.00 0.00 H new ATOM 0 HG SER A 100 -1.225 -1.433 -7.162 1.00 0.00 H new ATOM 1563 N VAL A 101 -0.490 -2.249 -10.280 1.00 0.00 N ATOM 1564 CA VAL A 101 0.650 -3.045 -10.810 1.00 0.00 C ATOM 1565 C VAL A 101 1.825 -2.794 -9.823 1.00 0.00 C ATOM 1566 O VAL A 101 2.527 -1.782 -9.924 1.00 0.00 O ATOM 1567 CB VAL A 101 0.968 -2.652 -12.298 1.00 0.00 C ATOM 1568 CG1 VAL A 101 2.228 -3.349 -12.867 1.00 0.00 C ATOM 1569 CG2 VAL A 101 -0.206 -2.928 -13.267 1.00 0.00 C ATOM 0 H VAL A 101 -0.464 -1.267 -10.554 1.00 0.00 H new ATOM 0 HA VAL A 101 0.434 -4.112 -10.860 1.00 0.00 H new ATOM 0 HB VAL A 101 1.148 -1.579 -12.241 1.00 0.00 H new ATOM 0 HG11 VAL A 101 2.386 -3.031 -13.897 1.00 0.00 H new ATOM 0 HG12 VAL A 101 3.096 -3.078 -12.266 1.00 0.00 H new ATOM 0 HG13 VAL A 101 2.090 -4.430 -12.838 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.079 -2.634 -14.277 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -0.448 -3.991 -13.253 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -1.078 -2.353 -12.955 1.00 0.00 H new ATOM 1579 N THR A 102 2.014 -3.718 -8.863 1.00 0.00 N ATOM 1580 CA THR A 102 2.970 -3.529 -7.739 1.00 0.00 C ATOM 1581 C THR A 102 4.325 -4.181 -8.146 1.00 0.00 C ATOM 1582 O THR A 102 4.539 -5.376 -7.919 1.00 0.00 O ATOM 1583 CB THR A 102 2.341 -4.095 -6.430 1.00 0.00 C ATOM 1584 OG1 THR A 102 1.029 -3.580 -6.219 1.00 0.00 O ATOM 1585 CG2 THR A 102 3.153 -3.767 -5.170 1.00 0.00 C ATOM 0 H THR A 102 1.518 -4.609 -8.837 1.00 0.00 H new ATOM 0 HA THR A 102 3.174 -2.478 -7.534 1.00 0.00 H new ATOM 0 HB THR A 102 2.327 -5.175 -6.579 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.026 -2.615 -6.387 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.657 -4.191 -4.297 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.153 -4.191 -5.261 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.226 -2.685 -5.056 1.00 0.00 H new ATOM 1593 N GLU A 103 5.211 -3.387 -8.783 1.00 0.00 N ATOM 1594 CA GLU A 103 6.447 -3.909 -9.424 1.00 0.00 C ATOM 1595 C GLU A 103 7.673 -3.594 -8.535 1.00 0.00 C ATOM 1596 O GLU A 103 7.883 -2.449 -8.133 1.00 0.00 O ATOM 1597 CB GLU A 103 6.608 -3.318 -10.848 1.00 0.00 C ATOM 1598 CG GLU A 103 7.669 -4.023 -11.725 1.00 0.00 C ATOM 1599 CD GLU A 103 7.712 -3.488 -13.157 1.00 0.00 C ATOM 1600 OE1 GLU A 103 6.857 -3.890 -13.977 1.00 0.00 O ATOM 1601 OE2 GLU A 103 8.600 -2.666 -13.471 1.00 0.00 O ATOM 0 H GLU A 103 5.097 -2.377 -8.870 1.00 0.00 H new ATOM 0 HA GLU A 103 6.372 -4.992 -9.525 1.00 0.00 H new ATOM 0 HB2 GLU A 103 5.646 -3.366 -11.357 1.00 0.00 H new ATOM 0 HB3 GLU A 103 6.871 -2.264 -10.761 1.00 0.00 H new ATOM 0 HG2 GLU A 103 8.651 -3.900 -11.267 1.00 0.00 H new ATOM 0 HG3 GLU A 103 7.460 -5.093 -11.749 1.00 0.00 H new ATOM 1608 N LEU A 104 8.488 -4.620 -8.270 1.00 0.00 N ATOM 1609 CA LEU A 104 9.663 -4.512 -7.364 1.00 0.00 C ATOM 1610 C LEU A 104 10.949 -4.600 -8.226 1.00 0.00 C ATOM 1611 O LEU A 104 11.282 -5.672 -8.745 1.00 0.00 O ATOM 1612 CB LEU A 104 9.573 -5.624 -6.278 1.00 0.00 C ATOM 1613 CG LEU A 104 10.158 -5.274 -4.884 1.00 0.00 C ATOM 1614 CD1 LEU A 104 9.969 -6.474 -3.947 1.00 0.00 C ATOM 1615 CD2 LEU A 104 11.633 -4.831 -4.871 1.00 0.00 C ATOM 0 H LEU A 104 8.363 -5.550 -8.670 1.00 0.00 H new ATOM 0 HA LEU A 104 9.684 -3.559 -6.836 1.00 0.00 H new ATOM 0 HB2 LEU A 104 8.525 -5.894 -6.151 1.00 0.00 H new ATOM 0 HB3 LEU A 104 10.087 -6.510 -6.652 1.00 0.00 H new ATOM 0 HG LEU A 104 9.602 -4.400 -4.545 1.00 0.00 H new ATOM 0 HD11 LEU A 104 10.378 -6.237 -2.965 1.00 0.00 H new ATOM 0 HD12 LEU A 104 8.907 -6.699 -3.853 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.488 -7.340 -4.356 1.00 0.00 H new ATOM 0 HD21 LEU A 104 11.938 -4.611 -3.848 1.00 0.00 H new ATOM 0 HD22 LEU A 104 12.256 -5.630 -5.272 1.00 0.00 H new ATOM 0 HD23 LEU A 104 11.750 -3.937 -5.484 1.00 0.00 H new ATOM 1627 N ASN A 105 11.658 -3.468 -8.396 1.00 0.00 N ATOM 1628 CA ASN A 105 12.786 -3.376 -9.368 1.00 0.00 C ATOM 1629 C ASN A 105 14.131 -3.645 -8.634 1.00 0.00 C ATOM 1630 O ASN A 105 14.506 -4.814 -8.493 1.00 0.00 O ATOM 1631 CB ASN A 105 12.675 -2.075 -10.221 1.00 0.00 C ATOM 1632 CG ASN A 105 11.522 -2.028 -11.249 1.00 0.00 C ATOM 1633 OD1 ASN A 105 11.700 -2.343 -12.425 1.00 0.00 O ATOM 1634 ND2 ASN A 105 10.330 -1.625 -10.835 1.00 0.00 N ATOM 0 H ASN A 105 11.479 -2.606 -7.882 1.00 0.00 H new ATOM 0 HA ASN A 105 12.737 -4.161 -10.123 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.563 -1.229 -9.543 1.00 0.00 H new ATOM 0 HB3 ASN A 105 13.615 -1.934 -10.754 1.00 0.00 H new ATOM 0 HD21 ASN A 105 9.552 -1.574 -11.493 1.00 0.00 H new ATOM 0 HD22 ASN A 105 10.190 -1.366 -9.859 1.00 0.00 H new ATOM 1641 N GLY A 106 14.834 -2.603 -8.158 1.00 0.00 N ATOM 1642 CA GLY A 106 16.132 -2.750 -7.457 1.00 0.00 C ATOM 1643 C GLY A 106 15.953 -3.028 -5.952 1.00 0.00 C ATOM 1644 O GLY A 106 15.723 -4.180 -5.572 1.00 0.00 O ATOM 0 H GLY A 106 14.524 -1.635 -8.245 1.00 0.00 H new ATOM 0 HA2 GLY A 106 16.698 -3.564 -7.910 1.00 0.00 H new ATOM 0 HA3 GLY A 106 16.719 -1.841 -7.589 1.00 0.00 H new ATOM 1648 N ASP A 107 16.037 -1.976 -5.116 1.00 0.00 N ATOM 1649 CA ASP A 107 15.602 -2.052 -3.690 1.00 0.00 C ATOM 1650 C ASP A 107 14.589 -0.906 -3.371 1.00 0.00 C ATOM 1651 O ASP A 107 14.775 -0.124 -2.433 1.00 0.00 O ATOM 1652 CB ASP A 107 16.828 -2.058 -2.736 1.00 0.00 C ATOM 1653 CG ASP A 107 17.691 -3.329 -2.780 1.00 0.00 C ATOM 1654 OD1 ASP A 107 17.344 -4.319 -2.097 1.00 0.00 O ATOM 1655 OD2 ASP A 107 18.711 -3.340 -3.503 1.00 0.00 O ATOM 0 H ASP A 107 16.399 -1.063 -5.392 1.00 0.00 H new ATOM 0 HA ASP A 107 15.080 -2.994 -3.525 1.00 0.00 H new ATOM 0 HB2 ASP A 107 17.459 -1.202 -2.977 1.00 0.00 H new ATOM 0 HB3 ASP A 107 16.473 -1.915 -1.715 1.00 0.00 H new ATOM 1660 N ILE A 108 13.491 -0.841 -4.147 1.00 0.00 N ATOM 1661 CA ILE A 108 12.360 0.098 -3.935 1.00 0.00 C ATOM 1662 C ILE A 108 11.038 -0.723 -4.101 1.00 0.00 C ATOM 1663 O ILE A 108 11.013 -1.948 -3.929 1.00 0.00 O ATOM 1664 CB ILE A 108 12.506 1.408 -4.811 1.00 0.00 C ATOM 1665 CG1 ILE A 108 12.316 1.278 -6.352 1.00 0.00 C ATOM 1666 CG2 ILE A 108 13.773 2.240 -4.515 1.00 0.00 C ATOM 1667 CD1 ILE A 108 13.255 0.319 -7.083 1.00 0.00 C ATOM 0 H ILE A 108 13.357 -1.449 -4.955 1.00 0.00 H new ATOM 0 HA ILE A 108 12.349 0.512 -2.927 1.00 0.00 H new ATOM 0 HB ILE A 108 11.627 1.948 -4.458 1.00 0.00 H new ATOM 0 HG12 ILE A 108 11.291 0.961 -6.542 1.00 0.00 H new ATOM 0 HG13 ILE A 108 12.431 2.268 -6.793 1.00 0.00 H new ATOM 0 HG21 ILE A 108 13.791 3.118 -5.160 1.00 0.00 H new ATOM 0 HG22 ILE A 108 13.765 2.556 -3.472 1.00 0.00 H new ATOM 0 HG23 ILE A 108 14.659 1.633 -4.703 1.00 0.00 H new ATOM 0 HD11 ILE A 108 13.020 0.320 -8.147 1.00 0.00 H new ATOM 0 HD12 ILE A 108 14.287 0.640 -6.939 1.00 0.00 H new ATOM 0 HD13 ILE A 108 13.129 -0.688 -6.685 1.00 0.00 H new ATOM 1679 N ILE A 109 9.919 -0.053 -4.424 1.00 0.00 N ATOM 1680 CA ILE A 109 8.740 -0.710 -5.034 1.00 0.00 C ATOM 1681 C ILE A 109 7.972 0.409 -5.795 1.00 0.00 C ATOM 1682 O ILE A 109 7.528 1.398 -5.203 1.00 0.00 O ATOM 1683 CB ILE A 109 7.897 -1.544 -4.002 1.00 0.00 C ATOM 1684 CG1 ILE A 109 7.043 -2.645 -4.682 1.00 0.00 C ATOM 1685 CG2 ILE A 109 7.054 -0.696 -3.015 1.00 0.00 C ATOM 1686 CD1 ILE A 109 6.596 -3.750 -3.714 1.00 0.00 C ATOM 0 H ILE A 109 9.802 0.949 -4.274 1.00 0.00 H new ATOM 0 HA ILE A 109 9.027 -1.485 -5.744 1.00 0.00 H new ATOM 0 HB ILE A 109 8.648 -2.038 -3.385 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.162 -2.186 -5.131 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.618 -3.092 -5.493 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.507 -1.357 -2.343 1.00 0.00 H new ATOM 0 HG22 ILE A 109 7.714 -0.052 -2.434 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.348 -0.082 -3.574 1.00 0.00 H new ATOM 0 HD11 ILE A 109 6.003 -4.488 -4.254 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.473 -4.234 -3.284 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.995 -3.314 -2.917 1.00 0.00 H new ATOM 1698 N THR A 110 7.835 0.237 -7.118 1.00 0.00 N ATOM 1699 CA THR A 110 7.138 1.204 -8.002 1.00 0.00 C ATOM 1700 C THR A 110 5.690 0.672 -8.208 1.00 0.00 C ATOM 1701 O THR A 110 5.435 -0.157 -9.088 1.00 0.00 O ATOM 1702 CB THR A 110 7.947 1.385 -9.319 1.00 0.00 C ATOM 1703 OG1 THR A 110 9.291 1.772 -9.031 1.00 0.00 O ATOM 1704 CG2 THR A 110 7.368 2.451 -10.264 1.00 0.00 C ATOM 0 H THR A 110 8.202 -0.576 -7.613 1.00 0.00 H new ATOM 0 HA THR A 110 7.071 2.201 -7.567 1.00 0.00 H new ATOM 0 HB THR A 110 7.896 0.416 -9.815 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.787 1.880 -9.869 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.987 2.518 -11.159 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.352 2.175 -10.545 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.355 3.417 -9.759 1.00 0.00 H new ATOM 1712 N ASN A 111 4.758 1.158 -7.365 1.00 0.00 N ATOM 1713 CA ASN A 111 3.333 0.747 -7.412 1.00 0.00 C ATOM 1714 C ASN A 111 2.560 1.729 -8.327 1.00 0.00 C ATOM 1715 O ASN A 111 2.388 2.907 -8.005 1.00 0.00 O ATOM 1716 CB ASN A 111 2.736 0.655 -5.982 1.00 0.00 C ATOM 1717 CG ASN A 111 1.289 0.112 -5.923 1.00 0.00 C ATOM 1718 OD1 ASN A 111 0.884 -0.768 -6.682 1.00 0.00 O ATOM 1719 ND2 ASN A 111 0.482 0.638 -5.021 1.00 0.00 N ATOM 0 H ASN A 111 4.965 1.841 -6.636 1.00 0.00 H new ATOM 0 HA ASN A 111 3.243 -0.253 -7.837 1.00 0.00 H new ATOM 0 HB2 ASN A 111 3.376 0.014 -5.376 1.00 0.00 H new ATOM 0 HB3 ASN A 111 2.757 1.646 -5.529 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -0.483 0.315 -4.950 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.823 1.367 -4.395 1.00 0.00 H new ATOM 1726 N THR A 112 2.111 1.198 -9.471 1.00 0.00 N ATOM 1727 CA THR A 112 1.565 2.006 -10.586 1.00 0.00 C ATOM 1728 C THR A 112 0.043 1.702 -10.674 1.00 0.00 C ATOM 1729 O THR A 112 -0.379 0.733 -11.313 1.00 0.00 O ATOM 1730 CB THR A 112 2.355 1.691 -11.892 1.00 0.00 C ATOM 1731 OG1 THR A 112 3.762 1.807 -11.682 1.00 0.00 O ATOM 1732 CG2 THR A 112 2.007 2.631 -13.054 1.00 0.00 C ATOM 0 H THR A 112 2.113 0.195 -9.657 1.00 0.00 H new ATOM 0 HA THR A 112 1.683 3.078 -10.425 1.00 0.00 H new ATOM 0 HB THR A 112 2.068 0.672 -12.151 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.235 1.603 -12.516 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.592 2.357 -13.932 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.945 2.547 -13.285 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.236 3.659 -12.772 1.00 0.00 H new ATOM 1740 N MET A 113 -0.760 2.552 -10.015 1.00 0.00 N ATOM 1741 CA MET A 113 -2.241 2.431 -9.982 1.00 0.00 C ATOM 1742 C MET A 113 -2.838 3.275 -11.139 1.00 0.00 C ATOM 1743 O MET A 113 -2.975 4.499 -11.032 1.00 0.00 O ATOM 1744 CB MET A 113 -2.789 2.878 -8.603 1.00 0.00 C ATOM 1745 CG MET A 113 -2.596 1.881 -7.451 1.00 0.00 C ATOM 1746 SD MET A 113 -3.320 2.567 -5.947 1.00 0.00 S ATOM 1747 CE MET A 113 -3.520 1.077 -4.949 1.00 0.00 C ATOM 0 H MET A 113 -0.407 3.349 -9.485 1.00 0.00 H new ATOM 0 HA MET A 113 -2.535 1.391 -10.121 1.00 0.00 H new ATOM 0 HB2 MET A 113 -2.308 3.817 -8.330 1.00 0.00 H new ATOM 0 HB3 MET A 113 -3.855 3.083 -8.706 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.068 0.929 -7.695 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.535 1.682 -7.300 1.00 0.00 H new ATOM 0 HE1 MET A 113 -3.630 1.353 -3.900 1.00 0.00 H new ATOM 0 HE2 MET A 113 -4.408 0.536 -5.277 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.643 0.440 -5.066 1.00 0.00 H new ATOM 1757 N THR A 114 -3.172 2.599 -12.253 1.00 0.00 N ATOM 1758 CA THR A 114 -3.637 3.273 -13.497 1.00 0.00 C ATOM 1759 C THR A 114 -5.190 3.365 -13.473 1.00 0.00 C ATOM 1760 O THR A 114 -5.893 2.368 -13.673 1.00 0.00 O ATOM 1761 CB THR A 114 -3.084 2.618 -14.799 1.00 0.00 C ATOM 1762 OG1 THR A 114 -3.499 1.267 -14.940 1.00 0.00 O ATOM 1763 CG2 THR A 114 -1.554 2.659 -14.936 1.00 0.00 C ATOM 0 H THR A 114 -3.131 1.582 -12.325 1.00 0.00 H new ATOM 0 HA THR A 114 -3.226 4.282 -13.516 1.00 0.00 H new ATOM 0 HB THR A 114 -3.510 3.235 -15.590 1.00 0.00 H new ATOM 0 HG1 THR A 114 -3.131 0.897 -15.770 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.259 2.181 -15.870 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.216 3.695 -14.936 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.099 2.129 -14.099 1.00 0.00 H new ATOM 1771 N LEU A 115 -5.695 4.582 -13.205 1.00 0.00 N ATOM 1772 CA LEU A 115 -7.146 4.880 -13.120 1.00 0.00 C ATOM 1773 C LEU A 115 -7.576 5.594 -14.433 1.00 0.00 C ATOM 1774 O LEU A 115 -7.646 6.827 -14.490 1.00 0.00 O ATOM 1775 CB LEU A 115 -7.341 5.717 -11.820 1.00 0.00 C ATOM 1776 CG LEU A 115 -8.773 6.202 -11.467 1.00 0.00 C ATOM 1777 CD1 LEU A 115 -9.743 5.044 -11.171 1.00 0.00 C ATOM 1778 CD2 LEU A 115 -8.716 7.170 -10.270 1.00 0.00 C ATOM 0 H LEU A 115 -5.106 5.398 -13.039 1.00 0.00 H new ATOM 0 HA LEU A 115 -7.784 3.999 -13.045 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -6.975 5.122 -10.983 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.700 6.596 -11.891 1.00 0.00 H new ATOM 0 HG LEU A 115 -9.162 6.718 -12.345 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -10.727 5.446 -10.931 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -9.818 4.399 -12.047 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -9.371 4.465 -10.325 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -9.724 7.507 -10.027 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -8.286 6.659 -9.409 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.098 8.030 -10.527 1.00 0.00 H new ATOM 1790 N GLY A 116 -7.822 4.801 -15.496 1.00 0.00 N ATOM 1791 CA GLY A 116 -8.112 5.336 -16.846 1.00 0.00 C ATOM 1792 C GLY A 116 -6.860 5.906 -17.549 1.00 0.00 C ATOM 1793 O GLY A 116 -6.027 5.150 -18.056 1.00 0.00 O ATOM 0 H GLY A 116 -7.826 3.782 -15.446 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.539 4.544 -17.461 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -8.866 6.119 -16.767 1.00 0.00 H new ATOM 1797 N ASP A 117 -6.743 7.244 -17.531 1.00 0.00 N ATOM 1798 CA ASP A 117 -5.506 7.973 -17.955 1.00 0.00 C ATOM 1799 C ASP A 117 -4.568 8.426 -16.782 1.00 0.00 C ATOM 1800 O ASP A 117 -3.412 8.765 -17.054 1.00 0.00 O ATOM 1801 CB ASP A 117 -5.893 9.202 -18.825 1.00 0.00 C ATOM 1802 CG ASP A 117 -6.500 8.872 -20.198 1.00 0.00 C ATOM 1803 OD1 ASP A 117 -5.735 8.625 -21.157 1.00 0.00 O ATOM 1804 OD2 ASP A 117 -7.745 8.855 -20.320 1.00 0.00 O ATOM 0 H ASP A 117 -7.494 7.862 -17.225 1.00 0.00 H new ATOM 0 HA ASP A 117 -4.925 7.252 -18.529 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.606 9.810 -18.268 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -5.003 9.813 -18.977 1.00 0.00 H new ATOM 1809 N ILE A 118 -5.030 8.452 -15.510 1.00 0.00 N ATOM 1810 CA ILE A 118 -4.266 8.992 -14.348 1.00 0.00 C ATOM 1811 C ILE A 118 -3.297 7.874 -13.854 1.00 0.00 C ATOM 1812 O ILE A 118 -3.741 6.860 -13.306 1.00 0.00 O ATOM 1813 CB ILE A 118 -5.257 9.484 -13.229 1.00 0.00 C ATOM 1814 CG1 ILE A 118 -6.233 10.612 -13.695 1.00 0.00 C ATOM 1815 CG2 ILE A 118 -4.508 9.959 -11.955 1.00 0.00 C ATOM 1816 CD1 ILE A 118 -7.487 10.792 -12.822 1.00 0.00 C ATOM 0 H ILE A 118 -5.951 8.097 -15.253 1.00 0.00 H new ATOM 0 HA ILE A 118 -3.674 9.863 -14.631 1.00 0.00 H new ATOM 0 HB ILE A 118 -5.857 8.604 -12.997 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -5.688 11.556 -13.719 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -6.548 10.399 -14.717 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -5.231 10.290 -11.210 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -3.920 9.135 -11.550 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -3.846 10.786 -12.210 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -8.100 11.597 -13.227 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -8.062 9.866 -12.816 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -7.189 11.040 -11.803 1.00 0.00 H new ATOM 1828 N VAL A 119 -1.982 8.089 -14.032 1.00 0.00 N ATOM 1829 CA VAL A 119 -0.943 7.077 -13.692 1.00 0.00 C ATOM 1830 C VAL A 119 -0.365 7.480 -12.301 1.00 0.00 C ATOM 1831 O VAL A 119 0.545 8.313 -12.214 1.00 0.00 O ATOM 1832 CB VAL A 119 0.133 6.968 -14.833 1.00 0.00 C ATOM 1833 CG1 VAL A 119 1.211 5.902 -14.536 1.00 0.00 C ATOM 1834 CG2 VAL A 119 -0.451 6.651 -16.234 1.00 0.00 C ATOM 0 H VAL A 119 -1.603 8.957 -14.411 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.357 6.071 -13.620 1.00 0.00 H new ATOM 0 HB VAL A 119 0.572 7.965 -14.851 1.00 0.00 H new ATOM 0 HG11 VAL A 119 1.927 5.870 -15.357 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.730 6.157 -13.612 1.00 0.00 H new ATOM 0 HG13 VAL A 119 0.738 4.926 -14.429 1.00 0.00 H new ATOM 0 HG21 VAL A 119 0.359 6.593 -16.961 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -0.978 5.697 -16.201 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.145 7.439 -16.526 1.00 0.00 H new ATOM 1844 N PHE A 120 -0.902 6.866 -11.226 1.00 0.00 N ATOM 1845 CA PHE A 120 -0.471 7.141 -9.830 1.00 0.00 C ATOM 1846 C PHE A 120 0.740 6.242 -9.466 1.00 0.00 C ATOM 1847 O PHE A 120 0.576 5.094 -9.043 1.00 0.00 O ATOM 1848 CB PHE A 120 -1.690 6.984 -8.877 1.00 0.00 C ATOM 1849 CG PHE A 120 -1.466 7.155 -7.355 1.00 0.00 C ATOM 1850 CD1 PHE A 120 -0.651 8.169 -6.831 1.00 0.00 C ATOM 1851 CD2 PHE A 120 -2.122 6.290 -6.470 1.00 0.00 C ATOM 1852 CE1 PHE A 120 -0.499 8.313 -5.456 1.00 0.00 C ATOM 1853 CE2 PHE A 120 -1.978 6.443 -5.095 1.00 0.00 C ATOM 1854 CZ PHE A 120 -1.171 7.458 -4.589 1.00 0.00 C ATOM 0 H PHE A 120 -1.643 6.168 -11.295 1.00 0.00 H new ATOM 0 HA PHE A 120 -0.123 8.168 -9.721 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -2.446 7.707 -9.184 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -2.113 5.993 -9.040 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -0.137 8.843 -7.500 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -2.745 5.498 -6.858 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.141 9.089 -5.062 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -2.492 5.775 -4.420 1.00 0.00 H new ATOM 0 HZ PHE A 120 -1.066 7.582 -3.521 1.00 0.00 H new ATOM 1864 N LYS A 121 1.950 6.799 -9.642 1.00 0.00 N ATOM 1865 CA LYS A 121 3.218 6.045 -9.483 1.00 0.00 C ATOM 1866 C LYS A 121 3.871 6.419 -8.121 1.00 0.00 C ATOM 1867 O LYS A 121 4.371 7.531 -7.935 1.00 0.00 O ATOM 1868 CB LYS A 121 4.106 6.319 -10.725 1.00 0.00 C ATOM 1869 CG LYS A 121 5.335 5.393 -10.835 1.00 0.00 C ATOM 1870 CD LYS A 121 6.245 5.669 -12.053 1.00 0.00 C ATOM 1871 CE LYS A 121 5.652 5.377 -13.449 1.00 0.00 C ATOM 1872 NZ LYS A 121 5.387 3.945 -13.681 1.00 0.00 N ATOM 0 H LYS A 121 2.083 7.778 -9.897 1.00 0.00 H new ATOM 0 HA LYS A 121 3.058 4.968 -9.445 1.00 0.00 H new ATOM 0 HB2 LYS A 121 3.499 6.209 -11.624 1.00 0.00 H new ATOM 0 HB3 LYS A 121 4.446 7.354 -10.695 1.00 0.00 H new ATOM 0 HG2 LYS A 121 5.929 5.490 -9.926 1.00 0.00 H new ATOM 0 HG3 LYS A 121 4.991 4.360 -10.882 1.00 0.00 H new ATOM 0 HD2 LYS A 121 6.543 6.717 -12.023 1.00 0.00 H new ATOM 0 HD3 LYS A 121 7.153 5.076 -11.939 1.00 0.00 H new ATOM 0 HE2 LYS A 121 4.723 5.935 -13.566 1.00 0.00 H new ATOM 0 HE3 LYS A 121 6.340 5.741 -14.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 4.839 3.831 -14.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 6.289 3.435 -13.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 4.846 3.558 -12.881 1.00 0.00 H new ATOM 1886 N ARG A 122 3.855 5.458 -7.181 1.00 0.00 N ATOM 1887 CA ARG A 122 4.441 5.619 -5.823 1.00 0.00 C ATOM 1888 C ARG A 122 5.815 4.907 -5.778 1.00 0.00 C ATOM 1889 O ARG A 122 5.888 3.686 -5.945 1.00 0.00 O ATOM 1890 CB ARG A 122 3.481 5.029 -4.752 1.00 0.00 C ATOM 1891 CG ARG A 122 2.262 5.927 -4.443 1.00 0.00 C ATOM 1892 CD ARG A 122 1.466 5.540 -3.183 1.00 0.00 C ATOM 1893 NE ARG A 122 0.589 4.358 -3.386 1.00 0.00 N ATOM 1894 CZ ARG A 122 -0.486 4.069 -2.626 1.00 0.00 C ATOM 1895 NH1 ARG A 122 -0.888 4.804 -1.590 1.00 0.00 N ATOM 1896 NH2 ARG A 122 -1.189 2.993 -2.925 1.00 0.00 N ATOM 0 H ARG A 122 3.435 4.541 -7.335 1.00 0.00 H new ATOM 0 HA ARG A 122 4.579 6.678 -5.605 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.126 4.056 -5.092 1.00 0.00 H new ATOM 0 HB3 ARG A 122 4.039 4.861 -3.831 1.00 0.00 H new ATOM 0 HG2 ARG A 122 2.607 6.955 -4.334 1.00 0.00 H new ATOM 0 HG3 ARG A 122 1.588 5.906 -5.300 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.162 5.333 -2.370 1.00 0.00 H new ATOM 0 HD3 ARG A 122 0.856 6.388 -2.872 1.00 0.00 H new ATOM 0 HE ARG A 122 0.815 3.723 -4.151 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -0.371 5.644 -1.330 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -1.712 4.527 -1.057 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -0.913 2.406 -3.713 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -2.008 2.748 -2.368 1.00 0.00 H new ATOM 1910 N ILE A 123 6.891 5.679 -5.536 1.00 0.00 N ATOM 1911 CA ILE A 123 8.284 5.147 -5.489 1.00 0.00 C ATOM 1912 C ILE A 123 8.634 5.113 -3.975 1.00 0.00 C ATOM 1913 O ILE A 123 8.910 6.156 -3.374 1.00 0.00 O ATOM 1914 CB ILE A 123 9.298 5.981 -6.357 1.00 0.00 C ATOM 1915 CG1 ILE A 123 8.948 6.067 -7.879 1.00 0.00 C ATOM 1916 CG2 ILE A 123 10.738 5.410 -6.233 1.00 0.00 C ATOM 1917 CD1 ILE A 123 7.949 7.162 -8.287 1.00 0.00 C ATOM 0 H ILE A 123 6.830 6.683 -5.367 1.00 0.00 H new ATOM 0 HA ILE A 123 8.358 4.156 -5.937 1.00 0.00 H new ATOM 0 HB ILE A 123 9.228 6.989 -5.948 1.00 0.00 H new ATOM 0 HG12 ILE A 123 9.873 6.223 -8.434 1.00 0.00 H new ATOM 0 HG13 ILE A 123 8.547 5.103 -8.193 1.00 0.00 H new ATOM 0 HG21 ILE A 123 11.419 6.004 -6.842 1.00 0.00 H new ATOM 0 HG22 ILE A 123 11.056 5.448 -5.191 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.750 4.376 -6.578 1.00 0.00 H new ATOM 0 HD11 ILE A 123 7.786 7.123 -9.364 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.003 7.002 -7.771 1.00 0.00 H new ATOM 0 HD13 ILE A 123 8.349 8.139 -8.016 1.00 0.00 H new ATOM 1929 N SER A 124 8.590 3.908 -3.384 1.00 0.00 N ATOM 1930 CA SER A 124 8.648 3.729 -1.912 1.00 0.00 C ATOM 1931 C SER A 124 9.847 2.806 -1.575 1.00 0.00 C ATOM 1932 O SER A 124 9.835 1.616 -1.905 1.00 0.00 O ATOM 1933 CB SER A 124 7.298 3.152 -1.420 1.00 0.00 C ATOM 1934 OG SER A 124 6.208 4.014 -1.723 1.00 0.00 O ATOM 0 H SER A 124 8.514 3.033 -3.902 1.00 0.00 H new ATOM 0 HA SER A 124 8.802 4.679 -1.400 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.130 2.179 -1.882 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.344 2.990 -0.343 1.00 0.00 H new ATOM 0 HG SER A 124 5.374 3.614 -1.398 1.00 0.00 H new ATOM 1940 N LYS A 125 10.900 3.364 -0.945 1.00 0.00 N ATOM 1941 CA LYS A 125 12.213 2.688 -0.824 1.00 0.00 C ATOM 1942 C LYS A 125 12.256 1.659 0.340 1.00 0.00 C ATOM 1943 O LYS A 125 11.794 1.927 1.454 1.00 0.00 O ATOM 1944 CB LYS A 125 13.328 3.763 -0.757 1.00 0.00 C ATOM 1945 CG LYS A 125 14.760 3.186 -0.835 1.00 0.00 C ATOM 1946 CD LYS A 125 15.791 4.080 -1.555 1.00 0.00 C ATOM 1947 CE LYS A 125 17.134 3.387 -1.863 1.00 0.00 C ATOM 1948 NZ LYS A 125 17.046 2.357 -2.918 1.00 0.00 N ATOM 0 H LYS A 125 10.869 4.286 -0.509 1.00 0.00 H new ATOM 0 HA LYS A 125 12.387 2.079 -1.711 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.187 4.470 -1.574 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.223 4.324 0.172 1.00 0.00 H new ATOM 0 HG2 LYS A 125 15.113 2.995 0.178 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.719 2.223 -1.345 1.00 0.00 H new ATOM 0 HD2 LYS A 125 15.356 4.434 -2.490 1.00 0.00 H new ATOM 0 HD3 LYS A 125 15.983 4.959 -0.940 1.00 0.00 H new ATOM 0 HE2 LYS A 125 17.861 4.141 -2.165 1.00 0.00 H new ATOM 0 HE3 LYS A 125 17.512 2.927 -0.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 17.973 1.900 -3.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 16.340 1.643 -2.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 16.764 2.802 -3.815 1.00 0.00 H new ATOM 1962 N ARG A 126 12.857 0.490 0.050 1.00 0.00 N ATOM 1963 CA ARG A 126 12.951 -0.651 0.987 1.00 0.00 C ATOM 1964 C ARG A 126 13.936 -0.349 2.157 1.00 0.00 C ATOM 1965 O ARG A 126 15.117 -0.059 1.941 1.00 0.00 O ATOM 1966 CB ARG A 126 13.381 -1.876 0.135 1.00 0.00 C ATOM 1967 CG ARG A 126 13.250 -3.230 0.855 1.00 0.00 C ATOM 1968 CD ARG A 126 13.568 -4.425 -0.068 1.00 0.00 C ATOM 1969 NE ARG A 126 13.486 -5.725 0.645 1.00 0.00 N ATOM 1970 CZ ARG A 126 14.521 -6.332 1.263 1.00 0.00 C ATOM 1971 NH1 ARG A 126 15.749 -5.820 1.337 1.00 0.00 N ATOM 1972 NH2 ARG A 126 14.306 -7.504 1.833 1.00 0.00 N ATOM 0 H ARG A 126 13.297 0.307 -0.852 1.00 0.00 H new ATOM 0 HA ARG A 126 11.996 -0.850 1.474 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.778 -1.901 -0.773 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.417 -1.742 -0.175 1.00 0.00 H new ATOM 0 HG2 ARG A 126 13.923 -3.248 1.712 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.237 -3.335 1.243 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.872 -4.429 -0.907 1.00 0.00 H new ATOM 0 HD3 ARG A 126 14.568 -4.304 -0.484 1.00 0.00 H new ATOM 0 HE ARG A 126 12.581 -6.194 0.670 1.00 0.00 H new ATOM 0 HH11 ARG A 126 15.951 -4.916 0.910 1.00 0.00 H new ATOM 0 HH12 ARG A 126 16.487 -6.332 1.820 1.00 0.00 H new ATOM 0 HH21 ARG A 126 13.378 -7.925 1.798 1.00 0.00 H new ATOM 0 HH22 ARG A 126 15.068 -7.988 2.308 1.00 0.00 H new ATOM 1986 N ILE A 127 13.395 -0.400 3.384 1.00 0.00 N ATOM 1987 CA ILE A 127 14.111 -0.004 4.622 1.00 0.00 C ATOM 1988 C ILE A 127 13.955 -1.172 5.608 1.00 0.00 C ATOM 1989 O ILE A 127 14.793 -2.072 5.667 1.00 0.00 O ATOM 1990 CB ILE A 127 13.615 1.357 5.230 1.00 0.00 C ATOM 1991 CG1 ILE A 127 12.077 1.450 5.493 1.00 0.00 C ATOM 1992 CG2 ILE A 127 14.116 2.557 4.387 1.00 0.00 C ATOM 1993 CD1 ILE A 127 11.637 2.546 6.474 1.00 0.00 C ATOM 0 H ILE A 127 12.441 -0.719 3.554 1.00 0.00 H new ATOM 0 HA ILE A 127 15.161 0.183 4.395 1.00 0.00 H new ATOM 0 HB ILE A 127 14.064 1.399 6.222 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.573 1.616 4.541 1.00 0.00 H new ATOM 0 HG13 ILE A 127 11.733 0.488 5.873 1.00 0.00 H new ATOM 0 HG21 ILE A 127 13.759 3.487 4.829 1.00 0.00 H new ATOM 0 HG22 ILE A 127 15.206 2.559 4.369 1.00 0.00 H new ATOM 0 HG23 ILE A 127 13.736 2.470 3.369 1.00 0.00 H new ATOM 0 HD11 ILE A 127 10.553 2.522 6.584 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.104 2.375 7.444 1.00 0.00 H new ATOM 0 HD13 ILE A 127 11.942 3.520 6.092 1.00 0.00 H new TER 2005 ILE A 127